![4NC 4NC](https://data.pdbj.org/pdbjplus/data/cc/svg/4NC.svg) | 4NC | 表記: | 4-NITROCATECHOL | 組成式: | C6 H5 N O4 | SMILES: | [O-][N+](=O)c1cc(O)c(O)cc1 | InChi: | InChI=1S/C6H5NO4/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3,8-9H | 定義日: | 1999-07-08 | 最終更新日: | 2011-06-04 | 識別子(ID): | 4-nitrobenzene-1,2-diol |
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![4NZ 4NZ](https://data.pdbj.org/pdbjplus/data/cc/svg/4NZ.svg) | 4NZ | 表記: | 4-nitrobenzenesulfonamide | 組成式: | C6 H6 N2 O4 S | SMILES: | O=S(=O)(N)c1ccc([N+]([O-])=O)cc1 | InChi: | InChI=1S/C6H6N2O4S/c7-13(11,12)6-3-1-5(2-4-6)8(9)10/h1-4H,(H2,7,11,12) | 定義日: | 2010-04-01 | 最終更新日: | 2011-06-04 | 識別子(ID): | 4-nitrobenzenesulfonamide |
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![EG3 EG3](https://data.pdbj.org/pdbjplus/data/cc/svg/EG3.svg) | EG3 | 表記: | PHENYLALANYLAMINODI(ETHYLOXY)ETHYL BENZENESULFONAMIDEAMINOCARBONYLBENZENESULFONAMIDE | 組成式: | C22 H30 N4 O6 S | SMILES: | O=S(=O)(N)c1ccc(cc1)C(=O)NCCOCCOCCNC(=O)C(N)Cc2ccccc2 | InChi: | InChI=1S/C22H30N4O6S/c23-20(16-17-4-2-1-3-5-17)22(28)26-11-13-32-15-14-31-12-10-25-21(27)18-6-8-19(9-7-18)33(24,29)30/h1-9,20H,10-16,23H2,(H,25,27)(H,26,28)(H2,24,29,30)/t20-/m0/s1 | 定義日: | 1999-07-08 | 最終更新日: | 2011-06-04 | 識別子(ID): | N-{2-[2-(2-{[(4-sulfamoylphenyl)carbonyl]amino}ethoxy)ethoxy]ethyl}-L-phenylalaninamide |
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![4SP 4SP](https://data.pdbj.org/pdbjplus/data/cc/svg/4SP.svg) | 4SP | 表記: | O6-CYCLOHEXYLMETHOXY-2-(4'-SULPHAMOYLANILINO) PURINE | 組成式: | C18 H22 N6 O3 S | SMILES: | O=S(=O)(N)c1ccc(cc1)Nc3nc2c(ncn2)c(n3)OCC4CCCCC4 | InChi: | InChI=1S/C18H22N6O3S/c19-28(25,26)14-8-6-13(7-9-14)22-18-23-16-15(20-11-21-16)17(24-18)27-10-12-4-2-1-3-5-12/h6-9,11-12H,1-5,10H2,(H2,19,25,26)(H2,20,21,22,23,24) | 定義日: | 2002-07-21 | 最終更新日: | 2011-06-04 | 識別子(ID): | 4-{[6-(cyclohexylmethoxy)-9H-purin-2-yl]amino}benzenesulfonamide |
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![EJT EJT](https://data.pdbj.org/pdbjplus/data/cc/svg/EJT.svg) | EJT | 表記: | 1,3-DI(N-PROPYLOXY-A-MANNOPYRANOSYL)-CARBOMYL 5-METHYAZIDO-BENZENE | 組成式: | C27 H41 N5 O14 | SMILES: | O=C(NCCCOC1OC(CO)C(O)C(O)C1O)c2cc(cc(c2)C/N=[N+]=[N-])C(=O)NCCCOC3OC(C(O)C(O)C3O)CO | InChi: | InChI=1S/C27H41N5O14/c28-32-31-10-13-7-14(24(41)29-3-1-5-43-26-22(39)20(37)18(35)16(11-33)45-26)9-15(8-13)25(42)30-4-2-6-44-27-23(40)21(38)19(36)17(12-34)46-27/h7-9,16-23,26-27,33-40H,1-6,10-12H2,(H,29,41)(H,30,42)/t16-,17-,18-,19-,20+,21+,22+,23+,26+,27+/m1/s1 | 定義日: | 1999-07-08 | 最終更新日: | 2011-06-04 | 識別子(ID): | 5-(azidomethyl)-N,N'-bis[3-(alpha-D-mannopyranosyloxy)propyl]benzene-1,3-dicarboxamide |
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![ESH ESH](https://data.pdbj.org/pdbjplus/data/cc/svg/ESH.svg) | ESH | 表記: | 4- [(1R,3AS,4R,8AS,8BR)- 2- (4-CHLOROBENZYL)- 1- ISOPROPYL- 3- OXODECAHYDROPYRROLO[3,4- A]PYRROLIZIN- 4- YL]BENZENECARBOXIMIDAMIDE | 組成式: | C26 H31 Cl N4 O | SMILES: | Clc1ccc(cc1)CN2C(=O)C5C(C2C(C)C)C3N(CCC3)C5c4ccc(C(=[N@H])N)cc4 | InChi: | InChI=1S/C26H31ClN4O/c1-15(2)23-21-20-4-3-13-30(20)24(17-7-9-18(10-8-17)25(28)29)22(21)26(32)31(23)14-16-5-11-19(27)12-6-16/h5-12,15,20-24H,3-4,13-14H2,1-2H3,(H3,28,29)/t20-,21-,22-,23+,24-/m0/s1 | 定義日: | 2006-02-17 | 最終更新日: | 2011-06-04 | 識別子(ID): | 4-[(1R,3aS,4R,8aS,8bR)-2-(4-chlorobenzyl)-1-(1-methylethyl)-3-oxodecahydropyrrolo[3,4-a]pyrrolizin-4-yl]benzenecarboximidamide |
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![ETP ETP](https://data.pdbj.org/pdbjplus/data/cc/svg/ETP.svg) | ETP | 表記: | 3-(4-BENZENESULFONYL-THIOPHENE-2-SULFONYLAMINO)-PHENYLBORONIC ACID | 組成式: | C16 H14 B N O6 S3 | SMILES: | O=S(=O)(c1csc(c1)S(=O)(=O)Nc2cccc(B(O)O)c2)c3ccccc3 | InChi: | InChI=1S/C16H14BNO6S3/c19-17(20)12-5-4-6-13(9-12)18-27(23,24)16-10-15(11-25-16)26(21,22)14-7-2-1-3-8-14/h1-11,18-20H | 定義日: | 2000-12-07 | 最終更新日: | 2011-06-04 | 識別子(ID): | [3-({[4-(phenylsulfonyl)thiophen-2-yl]sulfonyl}amino)phenyl]boronic acid |
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![LZ4 LZ4](https://data.pdbj.org/pdbjplus/data/cc/svg/LZ4.svg) | LZ4 | 表記: | 4-[(6-chloropyrazin-2-yl)amino]benzenesulfonamide | 組成式: | C10 H9 Cl N4 O2 S | SMILES: | Clc2nc(Nc1ccc(cc1)S(=O)(=O)N)cnc2 | InChi: | InChI=1S/C10H9ClN4O2S/c11-9-5-13-6-10(15-9)14-7-1-3-8(4-2-7)18(12,16)17/h1-6H,(H,14,15)(H2,12,16,17) | 定義日: | 2008-05-15 | 最終更新日: | 2011-06-04 | 識別子(ID): | 4-[(6-chloropyrazin-2-yl)amino]benzenesulfonamide |
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![5AF 5AF](https://data.pdbj.org/pdbjplus/data/cc/svg/5AF.svg) | 5AF | 表記: | 2,5-BIS{[4-(3-PENTYL)DIAMINOMETHYL]PHENYL}FURAN | 組成式: | C28 H40 N4 O | SMILES: | o1c(ccc1c2ccc(cc2)C(N)NC(CC)CC)c3ccc(cc3)C(N)NC(CC)CC | InChi: | InChI=1S/C28H40N4O/c1-5-23(6-2)31-27(29)21-13-9-19(10-14-21)25-17-18-26(33-25)20-11-15-22(16-12-20)28(30)32-24(7-3)8-4/h9-18,23-24,27-28,31-32H,5-8,29-30H2,1-4H3/t27-,28-/m0/s1 | 定義日: | 2006-05-09 | 最終更新日: | 2011-06-04 | 識別子(ID): | (S,S)-(furan-2,5-diyldibenzene-4,1-diyl)bis[N-(1-ethylpropyl)methanediamine] |
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![5B3 5B3](https://data.pdbj.org/pdbjplus/data/cc/svg/5B3.svg) | 5B3 | 表記: | 4-(3-amino-1H-indazol-5-yl)-N-tert-butylbenzenesulfonamide | 組成式: | C17 H20 N4 O2 S | SMILES: | O=S(=O)(NC(C)(C)C)c3ccc(c1cc2c(cc1)nnc2N)cc3 | InChi: | InChI=1S/C17H20N4O2S/c1-17(2,3)21-24(22,23)13-7-4-11(5-8-13)12-6-9-15-14(10-12)16(18)20-19-15/h4-10,21H,1-3H3,(H3,18,19,20) | 定義日: | 2008-08-19 | 最終更新日: | 2011-06-04 | 識別子(ID): | 4-(3-amino-1H-indazol-5-yl)-N-tert-butylbenzenesulfonamide |
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![5CL 5CL](https://data.pdbj.org/pdbjplus/data/cc/svg/5CL.svg) | 5CL | 表記: | 1,2,3,4,5-PENTACHLOROBENZENE | 組成式: | C6 H Cl5 | SMILES: | Clc1cc(Cl)c(Cl)c(Cl)c1Cl | InChi: | InChI=1S/C6HCl5/c7-2-1-3(8)5(10)6(11)4(2)9/h1H | 定義日: | 2006-04-26 | 最終更新日: | 2011-06-04 | 識別子(ID): | 1,2,3,4,5-pentachlorobenzene |
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![5FB 5FB](https://data.pdbj.org/pdbjplus/data/cc/svg/5FB.svg) | 5FB | 表記: | 4-(4-{[(5R)-2,4-dioxo-1,3-thiazolidin-5-yl]methyl}-2-methoxyphenoxy)-3-(trifluoromethyl)benzonitrile | 組成式: | C19 H13 F3 N2 O4 S | SMILES: | FC(F)(F)c3cc(C#N)ccc3Oc1c(OC)cc(cc1)CC2SC(=O)NC2=O | InChi: | InChI=1S/C19H13F3N2O4S/c1-27-15-7-10(8-16-17(25)24-18(26)29-16)2-5-14(15)28-13-4-3-11(9-23)6-12(13)19(20,21)22/h2-7,16H,8H2,1H3,(H,24,25,26)/t16-/m1/s1 | 定義日: | 2009-10-12 | 最終更新日: | 2011-06-04 | 識別子(ID): | 4-(4-{[(5R)-2,4-dioxo-1,3-thiazolidin-5-yl]methyl}-2-methoxyphenoxy)-3-(trifluoromethyl)benzonitrile |
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![M4S M4S](https://data.pdbj.org/pdbjplus/data/cc/svg/M4S.svg) | M4S | 表記: | 4-methoxybenzenesulfonamide | 組成式: | C7 H9 N O3 S | SMILES: | COc1ccc(cc1)[S](N)(=O)=O | InChi: | InChI=1S/C7H9NO3S/c1-11-6-2-4-7(5-3-6)12(8,9)10/h2-5H,1H3,(H2,8,9,10) | 定義日: | 2010-01-28 | 最終更新日: | 2011-06-04 | 識別子(ID): | 4-methoxybenzenesulfonamide |
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![5FW 5FW](https://data.pdbj.org/pdbjplus/data/cc/svg/5FW.svg) | 5FW | 表記: | ISOPRENALINE | 組成式: | C11 H17 N O3 | SMILES: | CC(C)NC[CH](O)c1ccc(O)c(O)c1 | InChi: | InChI=1S/C11H17NO3/c1-7(2)12-6-11(15)8-3-4-9(13)10(14)5-8/h3-5,7,11-15H,6H2,1-2H3/t11-/m0/s1 | 定義日: | 2010-11-30 | 最終更新日: | 2011-06-04 | 識別子(ID): | 4-[(1R)-1-hydroxy-2-(propan-2-ylamino)ethyl]benzene-1,2-diol |
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![5HA 5HA](https://data.pdbj.org/pdbjplus/data/cc/svg/5HA.svg) | 5HA | 表記: | N-[(1S,2R)-1-BENZYL-3-(CYCLOPROPYLAMINO)-2-HYDROXYPROPYL]-5-[METHYL(METHYLSULFONYL)AMINO]-N'-[(1R)-1-PHENYLETHYL]ISOPHTHALAMIDE | 組成式: | C31 H38 N4 O5 S | SMILES: | O=S(=O)(N(c2cc(cc(C(=O)NC(c1ccccc1)C)c2)C(=O)NC(C(O)CNC3CC3)Cc4ccccc4)C)C | InChi: | InChI=1S/C31H38N4O5S/c1-21(23-12-8-5-9-13-23)33-30(37)24-17-25(19-27(18-24)35(2)41(3,39)40)31(38)34-28(16-22-10-6-4-7-11-22)29(36)20-32-26-14-15-26/h4-13,17-19,21,26,28-29,32,36H,14-16,20H2,1-3H3,(H,33,37)(H,34,38)/t21-,28+,29-/m1/s1 | 定義日: | 2005-10-13 | 最終更新日: | 2011-06-04 | 識別子(ID): | N-[(1S,2R)-1-benzyl-3-(cyclopropylamino)-2-hydroxypropyl]-5-[methyl(methylsulfonyl)amino]-N'-[(1R)-1-phenylethyl]benzene-1,3-dicarboxamide |
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![5H 5H](https://data.pdbj.org/pdbjplus/data/cc/svg/5H.svg) | 5H | 表記: | 5R-(4-BROMOPHENYLMETHYL)-3-(BENZENESULFONYLAMINO)-4-OXO-2-THIONOTHIAZOLIDINE | 組成式: | C16 H13 Br N2 O3 S3 | SMILES: | O=S(=O)(NN1C(=O)C(SC1=S)Cc2ccc(Br)cc2)c3ccccc3 | InChi: | InChI=1S/C16H13BrN2O3S3/c17-12-8-6-11(7-9-12)10-14-15(20)19(16(23)24-14)18-25(21,22)13-4-2-1-3-5-13/h1-9,14,18H,10H2/t14-/m1/s1 | 定義日: | 2005-09-22 | 最終更新日: | 2011-06-04 | 識別子(ID): | N-[(5R)-5-(4-bromobenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzenesulfonamide |
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![DNC DNC](https://data.pdbj.org/pdbjplus/data/cc/svg/DNC.svg) | DNC | 表記: | 3,5-DINITROCATECHOL | 組成式: | C6 H4 N2 O6 | SMILES: | [O-][N+](=O)c1cc([N+]([O-])=O)cc(O)c1O | InChi: | InChI=1S/C6H4N2O6/c9-5-2-3(7(11)12)1-4(6(5)10)8(13)14/h1-2,9-10H | 定義日: | 1999-07-08 | 最終更新日: | 2011-06-04 | 識別子(ID): | 3,5-dinitrobenzene-1,2-diol |
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![DPS DPS](https://data.pdbj.org/pdbjplus/data/cc/svg/DPS.svg) | DPS | 表記: | 3-(1H-INDOL-3-YL)-2-[4-(4-PHENYL-PIPERIDIN-1-YL)-BENZENESULFONYLAMINO]-PROPIONIC ACID | 組成式: | C28 H29 N3 O4 S | SMILES: | O=C(O)C(NS(=O)(=O)c1ccc(cc1)N3CCC(c2ccccc2)CC3)Cc5c4ccccc4nc5 | InChi: | InChI=1S/C28H29N3O4S/c32-28(33)27(18-22-19-29-26-9-5-4-8-25(22)26)30-36(34,35)24-12-10-23(11-13-24)31-16-14-21(15-17-31)20-6-2-1-3-7-20/h1-13,19,21,27,29-30H,14-18H2,(H,32,33)/t27-/m0/s1 | 定義日: | 1999-07-08 | 最終更新日: | 2011-06-04 | 識別子(ID): | N-{[4-(4-phenylpiperidin-1-yl)phenyl]sulfonyl}-L-tryptophan |
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![DT1 DT1](https://data.pdbj.org/pdbjplus/data/cc/svg/DT1.svg) | DT1 | 表記: | 4-{[5-(CYCLOHEXYLMETHOXY)[1,2,4]TRIAZOLO[1,5-A]PYRIMIDIN-7-YL]AMINO}BENZENESULFONAMIDE | 組成式: | C18 H22 N6 O3 S | SMILES: | O=S(=O)(N)c1ccc(cc1)Nc2cc(nc3ncnn23)OCC4CCCCC4 | InChi: | InChI=1S/C18H22N6O3S/c19-28(25,26)15-8-6-14(7-9-15)22-16-10-17(23-18-20-12-21-24(16)18)27-11-13-4-2-1-3-5-13/h6-10,12-13,22H,1-5,11H2,(H2,19,25,26) | 定義日: | 2005-11-10 | 最終更新日: | 2011-06-04 | 識別子(ID): | 4-{[5-(cyclohexylmethoxy)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}benzenesulfonamide |
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![DT2 DT2](https://data.pdbj.org/pdbjplus/data/cc/svg/DT2.svg) | DT2 | 表記: | 4-{[5-(CYCLOHEXYLAMINO)[1,2,4]TRIAZOLO[1,5-A]PYRIMIDIN-7-YL]AMINO}BENZENESULFONAMIDE | 組成式: | C17 H21 N7 O2 S | SMILES: | O=S(=O)(N)c1ccc(cc1)Nc2cc(nc3ncnn23)NC4CCCCC4 | InChi: | InChI=1S/C17H21N7O2S/c18-27(25,26)14-8-6-13(7-9-14)22-16-10-15(21-12-4-2-1-3-5-12)23-17-19-11-20-24(16)17/h6-12,22H,1-5H2,(H2,18,25,26)(H,19,20,21,23) | 定義日: | 2005-11-10 | 最終更新日: | 2011-06-04 | 識別子(ID): | 4-{[5-(cyclohexylamino)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}benzenesulfonamide |
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![DT4 DT4](https://data.pdbj.org/pdbjplus/data/cc/svg/DT4.svg) | DT4 | 表記: | 4-({5-[(4-AMINOCYCLOHEXYL)AMINO][1,2,4]TRIAZOLO[1,5-A]PYRIMIDIN-7-YL}AMINO)BENZENESULFONAMIDE | 組成式: | C17 H22 N8 O2 S | SMILES: | O=S(=O)(N)c1ccc(cc1)Nc2cc(nc3ncnn23)NC4CCC(N)CC4 | InChi: | InChI=1S/C17H22N8O2S/c18-11-1-3-12(4-2-11)22-15-9-16(25-17(24-15)20-10-21-25)23-13-5-7-14(8-6-13)28(19,26)27/h5-12,23H,1-4,18H2,(H2,19,26,27)(H,20,21,22,24)/t11-,12- | 定義日: | 2005-11-10 | 最終更新日: | 2011-06-04 | 識別子(ID): | 4-({5-[(trans-4-aminocyclohexyl)amino][1,2,4]triazolo[1,5-a]pyrimidin-7-yl}amino)benzenesulfonamide |
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![DT5 DT5](https://data.pdbj.org/pdbjplus/data/cc/svg/DT5.svg) | DT5 | 表記: | 4-{[5-(CYCLOHEXYLOXY)[1,2,4]TRIAZOLO[1,5-A]PYRIMIDIN-7-YL]AMINO}BENZENESULFONAMIDE | 組成式: | C17 H20 N6 O3 S | SMILES: | O=S(=O)(N)c1ccc(cc1)Nc2cc(nc3ncnn23)OC4CCCCC4 | InChi: | InChI=1S/C17H20N6O3S/c18-27(24,25)14-8-6-12(7-9-14)21-15-10-16(22-17-19-11-20-23(15)17)26-13-4-2-1-3-5-13/h6-11,13,21H,1-5H2,(H2,18,24,25) | 定義日: | 2005-11-10 | 最終更新日: | 2011-06-04 | 識別子(ID): | 4-{[5-(cyclohexyloxy)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}benzenesulfonamide |
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![E02 E02](https://data.pdbj.org/pdbjplus/data/cc/svg/E02.svg) | E02 | 表記: | 5-(1H-benzimidazol-1-ylacetyl)-2-chlorobenzenesulfonamide | 組成式: | C15 H12 Cl N3 O3 S | SMILES: | O=S(=O)(N)c1c(Cl)ccc(c1)C(=O)Cn2c3ccccc3nc2 | InChi: | InChI=1S/C15H12ClN3O3S/c16-11-6-5-10(7-15(11)23(17,21)22)14(20)8-19-9-18-12-3-1-2-4-13(12)19/h1-7,9H,8H2,(H2,17,21,22) | 定義日: | 2010-03-22 | 最終更新日: | 2011-06-04 | 識別子(ID): | 5-(1H-benzimidazol-1-ylacetyl)-2-chlorobenzenesulfonamide |
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![MOB MOB](https://data.pdbj.org/pdbjplus/data/cc/svg/MOB.svg) | MOB | 表記: | 2-((3',5'-DIMETHOXY-4'-HYDROXYPHENYL)AZO)BENZOIC ACID | 組成式: | C15 H14 N2 O5 | SMILES: | O=C(O)c2ccccc2/N=N/c1cc(OC)c(O)c(OC)c1 | InChi: | InChI=1S/C15H14N2O5/c1-21-12-7-9(8-13(22-2)14(12)18)16-17-11-6-4-3-5-10(11)15(19)20/h3-8,18H,1-2H3,(H,19,20)/b17-16+ | 定義日: | 1999-07-08 | 最終更新日: | 2011-06-04 | 識別子(ID): | 2-[(E)-(4-hydroxy-3,5-dimethoxyphenyl)diazenyl]benzoic acid |
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![MPX MPX](https://data.pdbj.org/pdbjplus/data/cc/svg/MPX.svg) | MPX | 表記: | 4-({[(4-METHYLPIPERAZIN-1-YL)AMINO]CARBONOTHIOYL}AMINO)BENZENESULFONAMIDE | 組成式: | C12 H19 N5 O2 S2 | SMILES: | S=C(NN1CCN(CC1)C)Nc2ccc(cc2)S(=O)(=O)N | InChi: | InChI=1S/C12H19N5O2S2/c1-16-6-8-17(9-7-16)15-12(20)14-10-2-4-11(5-3-10)21(13,18)19/h2-5H,6-9H2,1H3,(H2,13,18,19)(H2,14,15,20) | 定義日: | 2005-09-13 | 最終更新日: | 2011-06-04 | 識別子(ID): | 4-{[(4-methylpiperazin-1-yl)carbamothioyl]amino}benzenesulfonamide |
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