| SNQ | Name: | 5-azanyl-2-pyrrol-1-yl-benzenecarbonitrile | Formula: | C11 H9 N3 | SMILES: | Nc1ccc(n2cccc2)c(c1)C#N | InChi: | InChI=1S/C11H9N3/c12-8-9-7-10(13)3-4-11(9)14-5-1-2-6-14/h1-7H,13H2 | Definition date: | 2011-07-11 | Last modified: | 2020-04-17 | Release date: | 2020-04-22 | Identifier: | 5-azanyl-2-pyrrol-1-yl-benzenecarbonitrile |
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| D8J | Name: | 2-amino-1,4-anhydro-2,5-dideoxy-5-[(4-fluorobenzene-1-carbonyl)amino]-D-arabinitol | Formula: | C12 H15 F N2 O3 | SMILES: | c1cc(F)ccc1C(=O)NCC2C(O)C(N)CO2 | InChi: | InChI=1S/C12H15FN2O3/c13-8-3-1-7(2-4-8)12(17)15-5-10-11(16)9(14)6-18-10/h1-4,9-11,16H,5-6,14H2,(H,15,17)/t9-,10-,11+/m1/s1 | Definition date: | 2017-10-23 | Last modified: | 2020-04-17 | Release date: | 2020-04-22 | Identifier: | 2-amino-1,4-anhydro-2,5-dideoxy-5-[(4-fluorobenzene-1-carbonyl)amino]-D-arabinitol |
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| EDJ | Name: | 2-({5-bromo-2-[(3,4,5-trimethoxyphenyl)amino]pyrimidin-4-yl}oxy)-N-methylbenzene-1-carboximidic acid | Formula: | C21 H21 Br N4 O5 | SMILES: | c1(c(Br)cnc(n1)Nc2cc(OC)c(OC)c(OC)c2)Oc3ccccc3/C(O)=N/C | InChi: | InChI=1S/C21H21BrN4O5/c1-23-19(27)13-7-5-6-8-15(13)31-20-14(22)11-24-21(26-20)25-12-9-16(28-2)18(30-4)17(10-12)29-3/h5-11H,1-4H3,(H,23,27)(H,24,25,26) | Definition date: | 2018-01-02 | Last modified: | 2020-04-13 | Release date: | 2018-05-09 | Identifier: | 2-({5-bromo-2-[(3,4,5-trimethoxyphenyl)amino]pyrimidin-4-yl}oxy)-N-methylbenzene-1-carboximidic acid |
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| KFH | Name: | 2,3,5,6-tetrakis(fluoranyl)benzenesulfonamide | Formula: | C6 H3 F4 N O2 S | SMILES: | N[S](=O)(=O)c1c(F)c(F)cc(F)c1F | InChi: | InChI=1S/C6H3F4NO2S/c7-2-1-3(8)5(10)6(4(2)9)14(11,12)13/h1H,(H2,11,12,13) | Definition date: | 2019-05-20 | Last modified: | 2020-04-10 | Release date: | 2020-04-15 | Identifier: | 2,3,5,6-tetrakis(fluoranyl)benzenesulfonamide |
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| KGK | Name: | 2,3,5,6-tetrakis(fluoranyl)-4-methyl-benzenesulfonamide | Formula: | C7 H5 F4 N O2 S | SMILES: | Cc1c(F)c(F)c(c(F)c1F)[S](N)(=O)=O | InChi: | InChI=1S/C7H5F4NO2S/c1-2-3(8)5(10)7(15(12,13)14)6(11)4(2)9/h1H3,(H2,12,13,14) | Definition date: | 2019-05-21 | Last modified: | 2020-04-10 | Release date: | 2020-04-15 | Identifier: | 2,3,5,6-tetrakis(fluoranyl)-4-methyl-benzenesulfonamide |
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| KJ5 | Name: | 4-ethyl-2,3,5,6-tetrakis(fluoranyl)benzenesulfonamide | Formula: | C8 H7 F4 N O2 S | SMILES: | CCc1c(F)c(F)c(c(F)c1F)[S](N)(=O)=O | InChi: | InChI=1S/C8H7F4NO2S/c1-2-3-4(9)6(11)8(16(13,14)15)7(12)5(3)10/h2H2,1H3,(H2,13,14,15) | Definition date: | 2019-05-22 | Last modified: | 2020-04-10 | Release date: | 2020-04-15 | Identifier: | 4-ethyl-2,3,5,6-tetrakis(fluoranyl)benzenesulfonamide |
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| U0Y | Name: | 1-[4-(4-methylbenzene-1-carbonyl)piperazin-1-yl]ethan-1-one | Formula: | C14 H18 N2 O2 | SMILES: | N2(CCN(C(c1ccc(cc1)C)=O)CC2)C(C)=O | InChi: | InChI=1S/C14H18N2O2/c1-11-3-5-13(6-4-11)14(18)16-9-7-15(8-10-16)12(2)17/h3-6H,7-10H2,1-2H3 | Definition date: | 2020-04-08 | Last modified: | 2020-04-10 | Release date: | 2020-04-15 | Identifier: | 1-[4-(4-methylbenzene-1-carbonyl)piperazin-1-yl]ethan-1-one |
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| L1Q | Name: | 2,3,5,6-tetrakis(fluoranyl)-4-propyl-benzenesulfonamide | Formula: | C9 H9 F4 N O2 S | SMILES: | CCCc1c(F)c(F)c(c(F)c1F)[S](N)(=O)=O | InChi: | InChI=1S/C9H9F4NO2S/c1-2-3-4-5(10)7(12)9(17(14,15)16)8(13)6(4)11/h2-3H2,1H3,(H2,14,15,16) | Definition date: | 2019-07-13 | Last modified: | 2020-04-10 | Release date: | 2020-04-15 | Identifier: | 2,3,5,6-tetrakis(fluoranyl)-4-propyl-benzenesulfonamide |
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| L7T | Name: | 2,3,4,5,6-pentafluorobenzenesulfonamide | Formula: | C6 H2 F5 N O2 S | SMILES: | N[S](=O)(=O)c1c(F)c(F)c(F)c(F)c1F | InChi: | InChI=1S/C6H2F5NO2S/c7-1-2(8)4(10)6(15(12,13)14)5(11)3(1)9/h(H2,12,13,14) | Definition date: | 2019-07-26 | Last modified: | 2020-04-10 | Release date: | 2020-04-15 | Identifier: | 2,3,4,5,6-pentakis(fluoranyl)benzenesulfonamide |
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| K5W | Name: | 2,3-bis(fluoranyl)benzenesulfonamide | Formula: | C6 H5 F2 N O2 S | SMILES: | N[S](=O)(=O)c1cccc(F)c1F | InChi: | InChI=1S/C6H5F2NO2S/c7-4-2-1-3-5(6(4)8)12(9,10)11/h1-3H,(H2,9,10,11) | Definition date: | 2019-04-29 | Last modified: | 2020-04-10 | Release date: | 2020-04-15 | Identifier: | 2,3-bis(fluoranyl)benzenesulfonamide |
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| KBB | Name: | 2,5-bis(fluoranyl)benzenesulfonamide | Formula: | C6 H5 F2 N O2 S | SMILES: | N[S](=O)(=O)c1cc(F)ccc1F | InChi: | InChI=1S/C6H5F2NO2S/c7-4-1-2-5(8)6(3-4)12(9,10)11/h1-3H,(H2,9,10,11) | Definition date: | 2019-05-09 | Last modified: | 2020-04-10 | Release date: | 2020-04-15 | Identifier: | 2,5-bis(fluoranyl)benzenesulfonamide |
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| KBZ | Name: | 4-cyanobenzenesulfonamide | Formula: | C7 H6 N2 O2 S | SMILES: | N[S](=O)(=O)c1ccc(cc1)C#N | InChi: | InChI=1S/C7H6N2O2S/c8-5-6-1-3-7(4-2-6)12(9,10)11/h1-4H,(H2,9,10,11) | Definition date: | 2019-05-10 | Last modified: | 2020-04-10 | Release date: | 2020-04-15 | Identifier: | 4-cyanobenzenesulfonamide |
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| Q8M | Name: | 5-bromo-3-chloro-N-(1-cyclopentyl-1H-imidazol-4-yl)-2-hydroxybenzene-1-sulfonamide | Formula: | C14 H15 Br Cl N3 O3 S | SMILES: | C1CC(CC1)n3cc(NS(c2cc(cc(c2O)Cl)Br)(=O)=O)nc3 | InChi: | InChI=1S/C14H15BrClN3O3S/c15-9-5-11(16)14(20)12(6-9)23(21,22)18-13-7-19(8-17-13)10-3-1-2-4-10/h5-8,10,18,20H,1-4H2 | Definition date: | 2019-10-03 | Last modified: | 2020-04-10 | Release date: | 2020-04-15 | Identifier: | 5-bromo-3-chloro-N-(1-cyclopentyl-1H-imidazol-4-yl)-2-hydroxybenzene-1-sulfonamide |
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| Q8S | Name: | 5-bromo-3-chloro-N-(1-cyclopentyl-2-methyl-1H-imidazol-4-yl)-2-hydroxybenzene-1-sulfonamide | Formula: | C15 H17 Br Cl N3 O3 S | SMILES: | C1CC(CC1)n3cc(NS(c2cc(cc(c2O)Cl)Br)(=O)=O)nc3C | InChi: | InChI=1S/C15H17BrClN3O3S/c1-9-18-14(8-20(9)11-4-2-3-5-11)19-24(22,23)13-7-10(16)6-12(17)15(13)21/h6-8,11,19,21H,2-5H2,1H3 | Definition date: | 2019-10-03 | Last modified: | 2020-04-10 | Release date: | 2020-04-15 | Identifier: | 5-bromo-3-chloro-N-(1-cyclopentyl-2-methyl-1H-imidazol-4-yl)-2-hydroxybenzene-1-sulfonamide |
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| QF1 | Name: | 5-bromo-3-chloro-N-[1-cyclopentyl-2-(methylsulfonyl)-1H-imidazol-4-yl]-2-hydroxybenzene-1-sulfonamide | Formula: | C15 H17 Br Cl N3 O5 S2 | SMILES: | CS(c2nc(cn2C1CCCC1)NS(c3cc(cc(c3O)Cl)Br)(=O)=O)(=O)=O | InChi: | InChI=1S/C15H17BrClN3O5S2/c1-26(22,23)15-18-13(8-20(15)10-4-2-3-5-10)19-27(24,25)12-7-9(16)6-11(17)14(12)21/h6-8,10,19,21H,2-5H2,1H3 | Definition date: | 2019-10-21 | Last modified: | 2020-04-10 | Release date: | 2020-04-15 | Identifier: | 5-bromo-3-chloro-N-[1-cyclopentyl-2-(methylsulfonyl)-1H-imidazol-4-yl]-2-hydroxybenzene-1-sulfonamide |
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| SXG | Name: | 2,3,4,5,6-pentafluoro-N-(2,3,5,6-tetrafluoro-4-sulfamoylphenyl)benzenesulfonamide | Formula: | C12 H3 F9 N2 O4 S2 | SMILES: | N[S](=O)(=O)c1c(F)c(F)c(N[S](=O)(=O)c2c(F)c(F)c(F)c(F)c2F)c(F)c1F | InChi: | InChI=1S/C12H3F9N2O4S2/c13-1-2(14)6(18)12(7(19)3(1)15)29(26,27)23-10-4(16)8(20)11(28(22,24)25)9(21)5(10)17/h23H,(H2,22,24,25) | Definition date: | 2019-07-26 | Last modified: | 2020-04-10 | Release date: | 2020-04-15 | Identifier: | 2,3,5,6-tetrakis(fluoranyl)-4-[[2,3,4,5,6-pentakis(fluoranyl)phenyl]sulfonylamino]benzenesulfonamide |
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| L4K | Name: | 4-pentylbenzenesulfonamide | Formula: | C11 H17 N O2 S | SMILES: | CCCCCc1ccc(cc1)[S](N)(=O)=O | InChi: | InChI=1S/C11H17NO2S/c1-2-3-4-5-10-6-8-11(9-7-10)15(12,13)14/h6-9H,2-5H2,1H3,(H2,12,13,14) | Definition date: | 2019-07-21 | Last modified: | 2020-04-03 | Release date: | 2020-04-08 | Identifier: | 4-pentylbenzenesulfonamide |
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| OKZ | Name: | 4-[2,5-bis(oxidanylidene)pyrrol-1-yl]-~{N}-propyl-benzenesulfonamide | Formula: | C13 H14 N2 O4 S | SMILES: | CCCN[S](=O)(=O)c1ccc(cc1)N2C(=O)C=CC2=O | InChi: | InChI=1S/C13H14N2O4S/c1-2-9-14-20(18,19)11-5-3-10(4-6-11)15-12(16)7-8-13(15)17/h3-8,14H,2,9H2,1H3 | Definition date: | 2020-03-19 | Last modified: | 2020-04-03 | Release date: | 2020-04-08 | Identifier: | 4-[2,5-bis(oxidanylidene)pyrrol-1-yl]-~{N}-propyl-benzenesulfonamide |
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| EVC | Name: | N-ethyl-2-[[4-[[4-(4-methylpiperazin-1-yl)-3-(2-morpholin-4-ylethoxy)phenyl]amino]-1,3,5-triazin-2-yl]amino]benzenesulfonamide | Formula: | C28 H39 N9 O4 S | SMILES: | CCN[S](=O)(=O)c1ccccc1Nc2ncnc(Nc3ccc(N4CCN(C)CC4)c(OCCN5CCOCC5)c3)n2 | InChi: | InChI=1S/C28H39N9O4S/c1-3-31-42(38,39)26-7-5-4-6-23(26)33-28-30-21-29-27(34-28)32-22-8-9-24(37-12-10-35(2)11-13-37)25(20-22)41-19-16-36-14-17-40-18-15-36/h4-9,20-21,31H,3,10-19H2,1-2H3,(H2,29,30,32,33,34) | Definition date: | 2020-02-05 | Last modified: | 2020-04-03 | Release date: | 2020-04-08 | Identifier: | ~{N}-ethyl-2-[[4-[[4-(4-methylpiperazin-1-yl)-3-(2-morpholin-4-ylethoxy)phenyl]amino]-1,3,5-triazin-2-yl]amino]benzenesulfonamide |
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| EVL | Name: | N-ethyl-2-[[4-[[3-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]amino]-1,3,5-triazin-2-yl]amino]benzenesulfonamide | Formula: | C28 H39 N9 O3 S | SMILES: | CCN[S](=O)(=O)c1ccccc1Nc2ncnc(Nc3ccc(N4CCC(CC4)N5CCN(C)CC5)c(OC)c3)n2 | InChi: | InChI=1S/C28H39N9O3S/c1-4-31-41(38,39)26-8-6-5-7-23(26)33-28-30-20-29-27(34-28)32-21-9-10-24(25(19-21)40-3)37-13-11-22(12-14-37)36-17-15-35(2)16-18-36/h5-10,19-20,22,31H,4,11-18H2,1-3H3,(H2,29,30,32,33,34) | Definition date: | 2020-02-05 | Last modified: | 2020-04-03 | Release date: | 2020-04-08 | Identifier: | ~{N}-ethyl-2-[[4-[[3-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]amino]-1,3,5-triazin-2-yl]amino]benzenesulfonamide |
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| EVR | Name: | 2-[[5-[2-(3,5-dimethoxyphenyl)ethyl]-2-[[3-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]amino]pyrimidin-4-yl]amino]-N-ethyl-benzenesulfonamide | Formula: | C39 H52 N8 O5 S | SMILES: | CCN[S](=O)(=O)c1ccccc1Nc2nc(Nc3ccc(N4CCC(CC4)N5CCN(C)CC5)c(OC)c3)ncc2CCc6cc(OC)cc(OC)c6 | InChi: | InChI=1S/C39H52N8O5S/c1-6-41-53(48,49)37-10-8-7-9-34(37)43-38-29(12-11-28-23-32(50-3)26-33(24-28)51-4)27-40-39(44-38)42-30-13-14-35(36(25-30)52-5)47-17-15-31(16-18-47)46-21-19-45(2)20-22-46/h7-10,13-14,23-27,31,41H,6,11-12,15-22H2,1-5H3,(H2,40,42,43,44) | Definition date: | 2020-02-05 | Last modified: | 2020-04-03 | Release date: | 2020-04-08 | Identifier: | 2-[[5-[2-(3,5-dimethoxyphenyl)ethyl]-2-[[3-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]amino]pyrimidin-4-yl]amino]-~{N}-ethyl-benzenesulfonamide |
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| QRY | Name: | 4-(2-{[(1R)-2-(1H-indol-3-yl)-2-oxo-1-phenylethyl]amino}ethyl)benzene-1-sulfonamide | Formula: | C24 H23 N3 O3 S | SMILES: | c1(ccc(S(N)(=O)=O)cc1)CCNC(c2ccccc2)C(c4cnc3ccccc34)=O | InChi: | InChI=1S/C24H23N3O3S/c25-31(29,30)19-12-10-17(11-13-19)14-15-26-23(18-6-2-1-3-7-18)24(28)21-16-27-22-9-5-4-8-20(21)22/h1-13,16,23,26-27H,14-15H2,(H2,25,29,30)/t23-/m1/s1 | Definition date: | 2019-12-13 | Last modified: | 2020-03-27 | Release date: | 2020-04-01 | Identifier: | 4-(2-{[(1R)-2-(1H-indol-3-yl)-2-oxo-1-phenylethyl]amino}ethyl)benzene-1-sulfonamide |
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| T4D | Name: | 2-[(4-acetylpiperazin-1-yl)sulfonyl]benzonitrile | Formula: | C13 H15 N3 O3 S | SMILES: | N1(CCN(CC1)C(C)=O)S(c2ccccc2C#N)(=O)=O | InChi: | InChI=1S/C13H15N3O3S/c1-11(17)15-6-8-16(9-7-15)20(18,19)13-5-3-2-4-12(13)10-14/h2-5H,6-9H2,1H3 | Definition date: | 2020-03-16 | Last modified: | 2020-03-20 | Release date: | 2020-03-25 | Identifier: | 2-[(4-acetylpiperazin-1-yl)sulfonyl]benzonitrile |
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| T5G | Name: | 4-bromobenzene-1-sulfonamide | Formula: | C6 H6 Br N O2 S | SMILES: | c1c(ccc(c1)Br)S(N)(=O)=O | InChi: | InChI=1S/C6H6BrNO2S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,(H2,8,9,10) | Definition date: | 2020-03-16 | Last modified: | 2020-03-20 | Release date: | 2020-03-25 | Identifier: | 4-bromobenzene-1-sulfonamide |
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| R0G | Name: | 4-({(1R,2R)-2-[(3R)-3-aminopiperidin-1-yl]-2,3-dihydro-1H-inden-1-yl}oxy)benzonitrile | Formula: | C21 H23 N3 O | SMILES: | c21c(cccc1)C(C(C2)N3CCCC(C3)N)Oc4ccc(cc4)C#N | InChi: | InChI=1S/C21H23N3O/c22-13-15-7-9-18(10-8-15)25-21-19-6-2-1-4-16(19)12-20(21)24-11-3-5-17(23)14-24/h1-2,4,6-10,17,20-21H,3,5,11-12,14,23H2/t17-,20-,21-/m1/s1 | Definition date: | 2020-01-21 | Last modified: | 2020-03-13 | Release date: | 2020-03-18 | Identifier: | 4-({(1R,2R)-2-[(3R)-3-aminopiperidin-1-yl]-2,3-dihydro-1H-inden-1-yl}oxy)benzonitrile |
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