![N48 N48](https://data.pdbj.org/pdbjplus/data/cc/svg/N48.svg) | N48 | Name: | 4-cyano-N-(7-methoxy-1,4-dimethyl-2-oxo-1,2-dihydroquinolin-6-yl)benzene-1-sulfonamide | Formula: | C19 H17 N3 O4 S | SMILES: | O=C1C=C(C)c2c(N1C)cc(c(c2)NS(=O)(=O)c3ccc(cc3)C#N)OC | InChi: | InChI=1S/C19H17N3O4S/c1-12-8-19(23)22(2)17-10-18(26-3)16(9-15(12)17)21-27(24,25)14-6-4-13(11-20)5-7-14/h4-10,21H,1-3H3 | Definition date: | 2016-08-30 | Last modified: | 2017-02-03 | Release date: | 2017-02-08 | Identifier: | 4-cyano-N-(7-methoxy-1,4-dimethyl-2-oxo-1,2-dihydroquinolin-6-yl)benzene-1-sulfonamide |
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![V98 V98](https://data.pdbj.org/pdbjplus/data/cc/svg/V98.svg) | V98 | Name: | ~{N}4-[(4-chlorophenyl)methyl]-~{N}4-cyclopentyl-~{N}1-(phenylmethyl)-~{N}1-(piperidin-4-ylmethyl)benzene-1,4-disulfonamide | Formula: | C31 H38 Cl N3 O4 S2 | SMILES: | Clc1ccc(CN(C2CCCC2)[S](=O)(=O)c3ccc(cc3)[S](=O)(=O)N(CC4CCNCC4)Cc5ccccc5)cc1 | InChi: | InChI=1S/C31H38ClN3O4S2/c32-28-12-10-26(11-13-28)24-35(29-8-4-5-9-29)41(38,39)31-16-14-30(15-17-31)40(36,37)34(22-25-6-2-1-3-7-25)23-27-18-20-33-21-19-27/h1-3,6-7,10-17,27,29,33H,4-5,8-9,18-24H2 | Definition date: | 2016-12-06 | Last modified: | 2017-01-26 | Release date: | 2017-02-01 | Identifier: | ~{N}4-[(4-chlorophenyl)methyl]-~{N}4-cyclopentyl-~{N}1-(phenylmethyl)-~{N}1-(piperidin-4-ylmethyl)benzene-1,4-disulfonamide |
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![66Z 66Z](https://data.pdbj.org/pdbjplus/data/cc/svg/66Z.svg) | 66Z | Name: | (1~{S},4~{R})-3-azabicyclo[2.2.1]hept-5-en-2-one | Formula: | C6 H7 N O | SMILES: | O=C1N[CH]2C[CH]1C=C2 | InChi: | InChI=1S/C6H7NO/c8-6-4-1-2-5(3-4)7-6/h1-2,4-5H,3H2,(H,7,8)/t4-,5+/m1/s1 | Definition date: | 2016-02-10 | Last modified: | 2017-01-26 | Release date: | 2017-02-01 | Identifier: | (1~{S},4~{R})-3-azabicyclo[2.2.1]hept-5-en-2-one |
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![NH6 NH6](https://data.pdbj.org/pdbjplus/data/cc/svg/NH6.svg) | NH6 | Name: | ~{N}1-[(4-chlorophenyl)methyl]-~{N}1-cyclopentyl-~{N}4-(phenylmethyl)benzene-1,4-disulfonamide | Formula: | C25 H27 Cl N2 O4 S2 | SMILES: | Clc1ccc(CN(C2CCCC2)[S](=O)(=O)c3ccc(cc3)[S](=O)(=O)NCc4ccccc4)cc1 | InChi: | InChI=1S/C25H27ClN2O4S2/c26-22-12-10-21(11-13-22)19-28(23-8-4-5-9-23)34(31,32)25-16-14-24(15-17-25)33(29,30)27-18-20-6-2-1-3-7-20/h1-3,6-7,10-17,23,27H,4-5,8-9,18-19H2 | Definition date: | 2016-12-06 | Last modified: | 2017-01-26 | Release date: | 2017-02-01 | Identifier: | ~{N}1-[(4-chlorophenyl)methyl]-~{N}1-cyclopentyl-~{N}4-(phenylmethyl)benzene-1,4-disulfonamide |
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![DL3 DL3](https://data.pdbj.org/pdbjplus/data/cc/svg/DL3.svg) | DL3 | Name: | ~{N}1-[(4-chlorophenyl)methyl]-~{N}1-cyclopentyl-~{N}4-[[2-(methylamino)pyrimidin-4-yl]methyl]-~{N}4-(piperidin-4-ylmethyl)benzene-1,4-disulfonamide | Formula: | C30 H39 Cl N6 O4 S2 | SMILES: | CNc1nccc(CN(CC2CCNCC2)[S](=O)(=O)c3ccc(cc3)[S](=O)(=O)N(Cc4ccc(Cl)cc4)C5CCCC5)n1 | InChi: | InChI=1S/C30H39ClN6O4S2/c1-32-30-34-19-16-26(35-30)22-36(20-24-14-17-33-18-15-24)42(38,39)28-10-12-29(13-11-28)43(40,41)37(27-4-2-3-5-27)21-23-6-8-25(31)9-7-23/h6-13,16,19,24,27,33H,2-5,14-15,17-18,20-22H2,1H3,(H,32,34,35) | Definition date: | 2016-12-06 | Last modified: | 2017-01-26 | Release date: | 2017-02-01 | Identifier: | ~{N}1-[(4-chlorophenyl)methyl]-~{N}1-cyclopentyl-~{N}4-[[2-(methylamino)pyrimidin-4-yl]methyl]-~{N}4-(piperidin-4-ylmethyl)benzene-1,4-disulfonamide |
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![P35 P35](https://data.pdbj.org/pdbjplus/data/cc/svg/P35.svg) | P35 | Name: | 4-({5-[(piperidin-4-yl)amino]-1,3-dihydro-2H-isoindol-2-yl}sulfonyl)benzene-1,3-diol | Formula: | C19 H23 N3 O4 S | SMILES: | c1cc(O)cc(c1S(=O)(N2Cc3ccc(cc3C2)NC4CCNCC4)=O)O | InChi: | InChI=1S/C19H23N3O4S/c23-17-3-4-19(18(24)10-17)27(25,26)22-11-13-1-2-16(9-14(13)12-22)21-15-5-7-20-8-6-15/h1-4,9-10,15,20-21,23-24H,5-8,11-12H2 | Definition date: | 2016-04-06 | Last modified: | 2017-01-20 | Release date: | 2017-01-25 | Identifier: | 4-({5-[(piperidin-4-yl)amino]-1,3-dihydro-2H-isoindol-2-yl}sulfonyl)benzene-1,3-diol |
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![86D 86D](https://data.pdbj.org/pdbjplus/data/cc/svg/86D.svg) | 86D | Name: | 3-({(1S)-7-[(difluoromethyl)sulfonyl]-2,2-difluoro-1-hydroxy-2,3-dihydro-1H-inden-4-yl}oxy)-5-fluorobenzonitrile | Formula: | C17 H10 F5 N O4 S | SMILES: | N#Cc1cc(cc(F)c1)Oc3c2CC(F)(F)C(c2c(cc3)S(=O)(=O)C(F)F)O | InChi: | InChI=1S/C17H10F5NO4S/c18-9-3-8(7-23)4-10(5-9)27-12-1-2-13(28(25,26)16(19)20)14-11(12)6-17(21,22)15(14)24/h1-5,15-16,24H,6H2/t15-/m0/s1 | Definition date: | 2017-01-06 | Last modified: | 2017-01-20 | Release date: | 2017-01-25 | Identifier: | 3-({(1S)-7-[(difluoromethyl)sulfonyl]-2,2-difluoro-1-hydroxy-2,3-dihydro-1H-inden-4-yl}oxy)-5-fluorobenzonitrile |
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![O44 O44](https://data.pdbj.org/pdbjplus/data/cc/svg/O44.svg) | O44 | Name: | 4-[(4-{4-[(3-cyclopropyl-1H-pyrazol-5-yl)amino]-6-[(prop-2-yn-1-yl)carbamoyl]pyrimidin-2-yl}piperazin-1-yl)methyl]benzene-1-sulfonyl fluoride | Formula: | C25 H27 F N8 O3 S | SMILES: | O=S(=O)(c1ccc(cc1)CN2CCN(CC2)c3nc(C(NCC#C)=O)cc(n3)Nc4cc(nn4)C5CC5)F | InChi: | InChI=1S/C25H27FN8O3S/c1-2-9-27-24(35)21-15-22(29-23-14-20(31-32-23)18-5-6-18)30-25(28-21)34-12-10-33(11-13-34)16-17-3-7-19(8-4-17)38(26,36)37/h1,3-4,7-8,14-15,18H,5-6,9-13,16H2,(H,27,35)(H2,28,29,30,31,32) | Definition date: | 2016-06-01 | Last modified: | 2017-01-20 | Release date: | 2017-01-25 | Identifier: | 4-[(4-{4-[(3-cyclopropyl-1H-pyrazol-5-yl)amino]-6-[(prop-2-yn-1-yl)carbamoyl]pyrimidin-2-yl}piperazin-1-yl)methyl]benzene-1-sulfonyl fluoride |
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![7EF 7EF](https://data.pdbj.org/pdbjplus/data/cc/svg/7EF.svg) | 7EF | Name: | 4-[2-(3-methylbut-2-en-1-yl)-7-(trifluoromethyl)-2H-indazol-3-yl]benzene-1,3-diol | Formula: | C19 H17 F3 N2 O2 | SMILES: | Oc1c(ccc(c1)O)c2n(nc3c2cccc3C(F)(F)F)C[C@H]=C(C)C | InChi: | InChI=1S/C19H17F3N2O2/c1-11(2)8-9-24-18(13-7-6-12(25)10-16(13)26)14-4-3-5-15(17(14)23-24)19(20,21)22/h3-8,10,25-26H,9H2,1-2H3 | Definition date: | 2016-10-14 | Last modified: | 2017-01-13 | Release date: | 2017-01-18 | Identifier: | 4-[2-(3-methylbut-2-en-1-yl)-7-(trifluoromethyl)-2H-indazol-3-yl]benzene-1,3-diol |
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![7M1 7M1](https://data.pdbj.org/pdbjplus/data/cc/svg/7M1.svg) | 7M1 | Name: | phenyl 4,4''-dihydroxy-[1,1':2',1''-terphenyl]-4'-sulfonate | Formula: | C24 H18 O5 S | SMILES: | Oc1ccc(cc1)c3cc(S(=O)(=O)Oc2ccccc2)ccc3c4ccc(cc4)O | InChi: | InChI=1S/C24H18O5S/c25-19-10-6-17(7-11-19)23-15-14-22(16-24(23)18-8-12-20(26)13-9-18)30(27,28)29-21-4-2-1-3-5-21/h1-16,25-26H | Definition date: | 2016-11-16 | Last modified: | 2017-01-13 | Release date: | 2017-01-18 | Identifier: | phenyl 1~4~,3~4~-dihydroxy[1~1~,2~1~:2~2~,3~1~-terphenyl]-2~4~-sulfonate |
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![7M7 7M7](https://data.pdbj.org/pdbjplus/data/cc/svg/7M7.svg) | 7M7 | Name: | 4-bromophenyl 4,4''-dihydroxy-[1,1':2',1''-terphenyl]-4'-sulfonate | Formula: | C24 H17 Br O5 S | SMILES: | Oc1ccc(cc1)c3cc(S(=O)(=O)Oc2ccc(cc2)Br)ccc3c4ccc(cc4)O | InChi: | InChI=1S/C24H17BrO5S/c25-18-5-11-21(12-6-18)30-31(28,29)22-13-14-23(16-1-7-19(26)8-2-16)24(15-22)17-3-9-20(27)10-4-17/h1-15,26-27H | Definition date: | 2016-11-16 | Last modified: | 2017-01-13 | Release date: | 2017-01-18 | Identifier: | 4-bromophenyl 1~4~,3~4~-dihydroxy[1~1~,2~1~:2~2~,3~1~-terphenyl]-2~4~-sulfonate |
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![72L 72L](https://data.pdbj.org/pdbjplus/data/cc/svg/72L.svg) | 72L | Name: | 4-[[6-(3-phenylphenyl)-7~{H}-purin-2-yl]amino]benzenesulfonamide | Formula: | C23 H18 N6 O2 S | SMILES: | N[S](=O)(=O)c1ccc(Nc2nc3nc[nH]c3c(n2)c4cccc(c4)c5ccccc5)cc1 | InChi: | InChI=1S/C23H18N6O2S/c24-32(30,31)19-11-9-18(10-12-19)27-23-28-20(21-22(29-23)26-14-25-21)17-8-4-7-16(13-17)15-5-2-1-3-6-15/h1-14H,(H2,24,30,31)(H2,25,26,27,28,29) | Definition date: | 2016-08-17 | Last modified: | 2017-01-06 | Release date: | 2017-01-11 | Identifier: | 4-[[6-(3-phenylphenyl)-7~{H}-purin-2-yl]amino]benzenesulfonamide |
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![7BK 7BK](https://data.pdbj.org/pdbjplus/data/cc/svg/7BK.svg) | 7BK | Name: | 2-fluoranyl-5-[2-[(4~{R})-4-methyl-2-oxidanylidene-4-phenyl-pyrrolidin-1-yl]ethoxy]benzenecarbonitrile | Formula: | C20 H19 F N2 O2 | SMILES: | C[C]1(CN(CCOc2ccc(F)c(c2)C#N)C(=O)C1)c3ccccc3 | InChi: | InChI=1S/C20H19FN2O2/c1-20(16-5-3-2-4-6-16)12-19(24)23(14-20)9-10-25-17-7-8-18(21)15(11-17)13-22/h2-8,11H,9-10,12,14H2,1H3/t20-/m0/s1 | Definition date: | 2016-09-29 | Last modified: | 2016-12-16 | Release date: | 2016-12-21 | Identifier: | 2-fluoranyl-5-[2-[(4~{R})-4-methyl-2-oxidanylidene-4-phenyl-pyrrolidin-1-yl]ethoxy]benzenecarbonitrile |
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![7BP 7BP](https://data.pdbj.org/pdbjplus/data/cc/svg/7BP.svg) | 7BP | Name: | 5-[2-[(4~{S})-4-~{tert}-butyl-2-oxidanylidene-pyrrolidin-1-yl]ethoxy]-2-fluoranyl-benzenecarbonitrile | Formula: | C17 H21 F N2 O2 | SMILES: | CC(C)(C)[CH]1CN(CCOc2ccc(F)c(c2)C#N)C(=O)C1 | InChi: | InChI=1S/C17H21FN2O2/c1-17(2,3)13-9-16(21)20(11-13)6-7-22-14-4-5-15(18)12(8-14)10-19/h4-5,8,13H,6-7,9,11H2,1-3H3/t13-/m1/s1 | Definition date: | 2016-09-29 | Last modified: | 2016-12-16 | Release date: | 2016-12-21 | Identifier: | 5-[2-[(4~{S})-4-~{tert}-butyl-2-oxidanylidene-pyrrolidin-1-yl]ethoxy]-2-fluoranyl-benzenecarbonitrile |
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![7BR 7BR](https://data.pdbj.org/pdbjplus/data/cc/svg/7BR.svg) | 7BR | Name: | 2-fluoranyl-5-[2-[(4~{S})-4-[4-methyl-1,1-bis(oxidanylidene)thian-4-yl]-2-oxidanylidene-pyrrolidin-1-yl]ethoxy]benzenecarbonitrile | Formula: | C19 H23 F N2 O4 S | SMILES: | CC1(CC[S](=O)(=O)CC1)[CH]2CN(CCOc3ccc(F)c(c3)C#N)C(=O)C2 | InChi: | InChI=1S/C19H23FN2O4S/c1-19(4-8-27(24,25)9-5-19)15-11-18(23)22(13-15)6-7-26-16-2-3-17(20)14(10-16)12-21/h2-3,10,15H,4-9,11,13H2,1H3/t15-/m1/s1 | Definition date: | 2016-09-29 | Last modified: | 2016-12-16 | Release date: | 2016-12-21 | Identifier: | 2-fluoranyl-5-[2-[(4~{S})-4-[4-methyl-1,1-bis(oxidanylidene)thian-4-yl]-2-oxidanylidene-pyrrolidin-1-yl]ethoxy]benzenecarbonitrile |
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![7BW 7BW](https://data.pdbj.org/pdbjplus/data/cc/svg/7BW.svg) | 7BW | Name: | 5-[2-(4,4-dimethyl-2-oxidanylidene-pyrrolidin-1-yl)ethoxy]-2-fluoranyl-benzenecarbonitrile | Formula: | C15 H17 F N2 O2 | SMILES: | CC1(C)CN(CCOc2ccc(F)c(c2)C#N)C(=O)C1 | InChi: | InChI=1S/C15H17FN2O2/c1-15(2)8-14(19)18(10-15)5-6-20-12-3-4-13(16)11(7-12)9-17/h3-4,7H,5-6,8,10H2,1-2H3 | Definition date: | 2016-09-30 | Last modified: | 2016-12-16 | Release date: | 2016-12-21 | Identifier: | 5-[2-(4,4-dimethyl-2-oxidanylidene-pyrrolidin-1-yl)ethoxy]-2-fluoranyl-benzenecarbonitrile |
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![7BX 7BX](https://data.pdbj.org/pdbjplus/data/cc/svg/7BX.svg) | 7BX | Name: | 3-cyano-~{N}-cyclopropyl-benzenesulfonamide | Formula: | C10 H10 N2 O2 S | SMILES: | O=[S](=O)(NC1CC1)c2cccc(c2)C#N | InChi: | InChI=1S/C10H10N2O2S/c11-7-8-2-1-3-10(6-8)15(13,14)12-9-4-5-9/h1-3,6,9,12H,4-5H2 | Definition date: | 2016-09-30 | Last modified: | 2016-12-16 | Release date: | 2016-12-21 | Identifier: | 3-cyano-~{N}-cyclopropyl-benzenesulfonamide |
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![7FM 7FM](https://data.pdbj.org/pdbjplus/data/cc/svg/7FM.svg) | 7FM | Name: | 25-(methylsulfonyl)-8-(trifluoromethyl)-5,17,18,21,22,23,24,25-octahydro-12H-7,11-(azeno)-16,13-(metheno)pyrido[3,2-i]pyrrolo[1,2-q][1,3,7,11,17]pentaazacyclohenicosin-20(6H)-one | Formula: | C25 H26 F3 N7 O3 S | SMILES: | c4c2Nc1ncc(c(n1)NCc5c(N(CCCCC(N3c(c(c2)CC3)c4)=O)S(=O)(=O)C)nccc5)C(F)(F)F | InChi: | InChI=1S/C25H26F3N7O3S/c1-39(37,38)35-11-3-2-6-21(36)34-12-9-16-13-18(7-8-20(16)34)32-24-31-15-19(25(26,27)28)22(33-24)30-14-17-5-4-10-29-23(17)35/h4-5,7-8,10,13,15H,2-3,6,9,11-12,14H2,1H3,(H2,30,31,32,33) | Definition date: | 2016-10-18 | Last modified: | 2016-12-16 | Release date: | 2016-12-21 | Identifier: | 25-(methylsulfonyl)-8-(trifluoromethyl)-5,17,18,21,22,23,24,25-octahydro-12H-7,11-(azeno)-16,13-(metheno)pyrido[3,2-i]pyrrolo[1,2-q][1,3,7,11,17]pentaazacyclohenicosin-20(6H)-one |
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![7K4 7K4](https://data.pdbj.org/pdbjplus/data/cc/svg/7K4.svg) | 7K4 | Name: | 2-fluoranyl-5-[2-[(4~{S})-4-methyl-2-oxidanylidene-4-phenyl-pyrrolidin-1-yl]ethoxy]benzenecarbonitrile | Formula: | C20 H19 F N2 O2 | SMILES: | C[C]1(CN(CCOc2ccc(F)c(c2)C#N)C(=O)C1)c3ccccc3 | InChi: | InChI=1S/C20H19FN2O2/c1-20(16-5-3-2-4-6-16)12-19(24)23(14-20)9-10-25-17-7-8-18(21)15(11-17)13-22/h2-8,11H,9-10,12,14H2,1H3/t20-/m1/s1 | Definition date: | 2016-11-03 | Last modified: | 2016-12-16 | Release date: | 2016-12-21 | Identifier: | 2-fluoranyl-5-[2-[(4~{S})-4-methyl-2-oxidanylidene-4-phenyl-pyrrolidin-1-yl]ethoxy]benzenecarbonitrile |
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![FIJ FIJ](https://data.pdbj.org/pdbjplus/data/cc/svg/FIJ.svg) | FIJ | Name: | 4-chloranyl-6-[(2~{S})-6-chloranyl-2,4,4-trimethyl-7-oxidanyl-3~{H}-chromen-2-yl]benzene-1,3-diol | Formula: | C18 H18 Cl2 O4 | SMILES: | CC1(C)C[C](C)(Oc2cc(O)c(Cl)cc12)c3cc(Cl)c(O)cc3O | InChi: | InChI=1S/C18H18Cl2O4/c1-17(2)8-18(3,9-4-11(19)14(22)6-13(9)21)24-16-7-15(23)12(20)5-10(16)17/h4-7,21-23H,8H2,1-3H3/t18-/m0/s1 | Definition date: | 2015-12-14 | Last modified: | 2016-12-09 | Release date: | 2016-12-14 | Identifier: | 4-chloranyl-6-[(2~{S})-6-chloranyl-2,4,4-trimethyl-7-oxidanyl-3~{H}-chromen-2-yl]benzene-1,3-diol |
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![4QQ 4QQ](https://data.pdbj.org/pdbjplus/data/cc/svg/4QQ.svg) | 4QQ | Name: | 4-[(2S)-2-{[(4-methylphenyl)sulfonyl]amino}-3-oxo-3-(piperidin-1-yl)propyl]benzene-1-carboximidamide | Formula: | C22 H28 N4 O3 S | SMILES: | S(=O)(=O)(c1ccc(cc1)C)NC(C(N2CCCCC2)=O)Cc3ccc(cc3)C(=N)N | InChi: | InChI=1S/C22H28N4O3S/c1-16-5-11-19(12-6-16)30(28,29)25-20(22(27)26-13-3-2-4-14-26)15-17-7-9-18(10-8-17)21(23)24/h5-12,20,25H,2-4,13-15H2,1H3,(H3,23,24)/t20-/m0/s1 | Definition date: | 2016-12-06 | Last modified: | 2016-12-09 | Release date: | 2016-12-14 | Identifier: | 4-[(2S)-2-{[(4-methylphenyl)sulfonyl]amino}-3-oxo-3-(piperidin-1-yl)propyl]benzene-1-carboximidamide |
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![6A8 6A8](https://data.pdbj.org/pdbjplus/data/cc/svg/6A8.svg) | 6A8 | Name: | ((R)-1-((S)-3-(4-(aminomethyl)phenyl)-2-benzamidopropaneamido)-4-guanidinobutyl)boronic acid, cyclic double ester with glycerol | Formula: | C25 H35 B N6 O5 | SMILES: | O=C(NC(Cc1ccc(cc1)CN)C(NC(B2OC(CO)CO2)CCCN/C(N)=N)=O)c3ccccc3 | InChi: | InChI=1S/C25H35BN6O5/c27-14-18-10-8-17(9-11-18)13-21(31-23(34)19-5-2-1-3-6-19)24(35)32-22(7-4-12-30-25(28)29)26-36-16-20(15-33)37-26/h1-3,5-6,8-11,20-22,33H,4,7,12-16,27H2,(H,31,34)(H,32,35)(H4,28,29,30)/t20-,21-,22-/m0/s1 | Definition date: | 2016-02-25 | Last modified: | 2016-12-09 | Release date: | 2016-12-14 | Identifier: | 4-(aminomethyl)-Nalpha-(benzenecarbonyl)-N-{(1R)-4-carbamimidamido-1-[(4S)-4-(hydroxymethyl)-1,3,2-dioxaborolan-2-yl]butyl}-L-phenylalaninamide |
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![6Q0 6Q0](https://data.pdbj.org/pdbjplus/data/cc/svg/6Q0.svg) | 6Q0 | Name: | ~{N}-[[4-(3,5-dimethyl-1,2-oxazol-4-yl)phenyl]methyl]benzenesulfonamide | Formula: | C18 H18 N2 O3 S | SMILES: | Cc1onc(C)c1c2ccc(CN[S](=O)(=O)c3ccccc3)cc2 | InChi: | InChI=1S/C18H18N2O3S/c1-13-18(14(2)23-20-13)16-10-8-15(9-11-16)12-19-24(21,22)17-6-4-3-5-7-17/h3-11,19H,12H2,1-2H3 | Definition date: | 2016-06-03 | Last modified: | 2016-12-02 | Release date: | 2016-12-07 | Identifier: | ~{N}-[[4-(3,5-dimethyl-1,2-oxazol-4-yl)phenyl]methyl]benzenesulfonamide |
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![79K 79K](https://data.pdbj.org/pdbjplus/data/cc/svg/79K.svg) | 79K | Name: | Vercirnon | Formula: | C22 H21 Cl N2 O4 S | SMILES: | CC(C)(C)c1ccc(cc1)[S](=O)(=O)Nc2ccc(Cl)cc2C(=O)c3cc[n+]([O-])cc3 | InChi: | InChI=1S/C22H21ClN2O4S/c1-22(2,3)16-4-7-18(8-5-16)30(28,29)24-20-9-6-17(23)14-19(20)21(26)15-10-12-25(27)13-11-15/h4-14,24H,1-3H3 | Definition date: | 2016-09-16 | Last modified: | 2016-12-02 | Release date: | 2016-12-07 | Identifier: | 4-~{tert}-butyl-~{N}-[4-chloranyl-2-(1-oxidanidylpyridin-1-ium-4-yl)carbonyl-phenyl]benzenesulfonamide |
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![7HH 7HH](https://data.pdbj.org/pdbjplus/data/cc/svg/7HH.svg) | 7HH | Name: | N-{3-[(benzenecarbonyl)amino]-4-[(4-chlorophenyl)methoxy]benzene-1-carbonyl}glycine | Formula: | C23 H19 Cl N2 O5 | SMILES: | N(CC(O)=O)C(c1ccc(c(c1)NC(=O)c2ccccc2)OCc3ccc(cc3)Cl)=O | InChi: | InChI=1S/C23H19ClN2O5/c24-18-9-6-15(7-10-18)14-31-20-11-8-17(22(29)25-13-21(27)28)12-19(20)26-23(30)16-4-2-1-3-5-16/h1-12H,13-14H2,(H,25,29)(H,26,30)(H,27,28) | Definition date: | 2016-10-28 | Last modified: | 2016-11-25 | Release date: | 2016-11-30 | Identifier: | N-{3-[(benzenecarbonyl)amino]-4-[(4-chlorophenyl)methoxy]benzene-1-carbonyl}glycine |
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