![264 264](https://data.pdbj.org/pdbjplus/data/cc/svg/264.svg) | 264 | Name: | (phenylamino)acetonitrile | Formula: | C8 H8 N2 | SMILES: | N#CCNc1ccccc1 | InChi: | InChI=1S/C8H8N2/c9-6-7-10-8-4-2-1-3-5-8/h1-5,10H,7H2 | Definition date: | 2007-10-02 | Last modified: | 2011-06-04 | Identifier: | (phenylamino)acetonitrile |
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![265 265](https://data.pdbj.org/pdbjplus/data/cc/svg/265.svg) | 265 | Name: | 2-nitrothiophene | Formula: | C4 H3 N O2 S | SMILES: | [O-][N+](=O)c1sccc1 | InChi: | InChI=1S/C4H3NO2S/c6-5(7)4-2-1-3-8-4/h1-3H | Definition date: | 2007-10-02 | Last modified: | 2011-06-04 | Identifier: | 2-nitrothiophene |
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![268 268](https://data.pdbj.org/pdbjplus/data/cc/svg/268.svg) | 268 | Name: | 2-phenoxyethanol | Formula: | C8 H10 O2 | SMILES: | O(c1ccccc1)CCO | InChi: | InChI=1S/C8H10O2/c9-6-7-10-8-4-2-1-3-5-8/h1-5,9H,6-7H2 | Definition date: | 2007-10-02 | Last modified: | 2011-06-04 | Identifier: | 2-phenoxyethanol |
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![269 269](https://data.pdbj.org/pdbjplus/data/cc/svg/269.svg) | 269 | Name: | (1R)-3-chloro-1-phenylpropan-1-ol | Formula: | C9 H11 Cl O | SMILES: | ClCCC(O)c1ccccc1 | InChi: | InChI=1S/C9H11ClO/c10-7-6-9(11)8-4-2-1-3-5-8/h1-5,9,11H,6-7H2/t9-/m1/s1 | Definition date: | 2007-10-02 | Last modified: | 2011-06-04 | Identifier: | (1R)-3-chloro-1-phenylpropan-1-ol |
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![26A 26A](https://data.pdbj.org/pdbjplus/data/cc/svg/26A.svg) | 26A | Name: | 6N-DIMETHYLADENOSINE | Formula: | C12 H17 N5 O4 | SMILES: | n2c1c(ncnc1N(C)C)n(c2)C3OC(C(O)C3O)CO | InChi: | InChI=1S/C12H17N5O4/c1-16(2)10-7-11(14-4-13-10)17(5-15-7)12-9(20)8(19)6(3-18)21-12/h4-6,8-9,12,18-20H,3H2,1-2H3/t6-,8-,9-,12-/m1/s1 | Definition date: | 2005-07-28 | Last modified: | 2011-06-04 | Identifier: | N,N-dimethyladenosine |
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![26B 26B](https://data.pdbj.org/pdbjplus/data/cc/svg/26B.svg) | 26B | Name: | O-tert-butyl-N-[(3-{[(2,4,6-trimethylphenyl)carbamoyl]amino}naphthalen-2-yl)carbonyl]-L-threonine | Formula: | C29 H35 N3 O5 | SMILES: | O=C(Nc1c(cc(cc1C)C)C)Nc3cc2ccccc2cc3C(=O)NC(C(=O)O)C(OC(C)(C)C)C | InChi: | InChI=1S/C29H35N3O5/c1-16-12-17(2)24(18(3)13-16)32-28(36)30-23-15-21-11-9-8-10-20(21)14-22(23)26(33)31-25(27(34)35)19(4)37-29(5,6)7/h8-15,19,25H,1-7H3,(H,31,33)(H,34,35)(H2,30,32,36)/t19-,25+/m1/s1 | Definition date: | 2008-06-10 | Last modified: | 2011-06-04 | Identifier: | O-tert-butyl-N-[(3-{[(2,4,6-trimethylphenyl)carbamoyl]amino}naphthalen-2-yl)carbonyl]-L-threonine |
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![26C 26C](https://data.pdbj.org/pdbjplus/data/cc/svg/26C.svg) | 26C | Name: | 2',6'-DIFLUOROBIPHENYL-4-CARBOXYLIC ACID | Formula: | C13 H8 F2 O2 | SMILES: | Fc2cccc(F)c2c1ccc(C(=O)O)cc1 | InChi: | InChI=1S/C13H8F2O2/c14-10-2-1-3-11(15)12(10)8-4-6-9(7-5-8)13(16)17/h1-7H,(H,16,17) | Definition date: | 2005-12-02 | Last modified: | 2011-06-04 | Identifier: | 2',6'-difluorobiphenyl-4-carboxylic acid |
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![26D 26D](https://data.pdbj.org/pdbjplus/data/cc/svg/26D.svg) | 26D | Name: | PYRIDINE-2,6-DIAMINE | Formula: | C5 H7 N3 | SMILES: | n1c(N)cccc1N | InChi: | InChI=1S/C5H7N3/c6-4-2-1-3-5(7)8-4/h1-3H,(H4,6,7,8) | Definition date: | 2005-08-23 | Last modified: | 2011-06-04 | Identifier: | pyridine-2,6-diamine |
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![26F 26F](https://data.pdbj.org/pdbjplus/data/cc/svg/26F.svg) | 26F | Name: | (2R)-4-(2,6-dimethoxypyrimidin-4-yl)-N-(4-methoxybenzyl)-1-{[4-(trifluoromethoxy)phenyl]sulfonyl}piperazine-2-carboxamide | Formula: | C26 H28 F3 N5 O7 S | SMILES: | O=S(=O)(c1ccc(OC(F)(F)F)cc1)N4C(C(=O)NCc2ccc(OC)cc2)CN(c3nc(OC)nc(OC)c3)CC4 | InChi: | InChI=1S/C26H28F3N5O7S/c1-38-18-6-4-17(5-7-18)15-30-24(35)21-16-33(22-14-23(39-2)32-25(31-22)40-3)12-13-34(21)42(36,37)20-10-8-19(9-11-20)41-26(27,28)29/h4-11,14,21H,12-13,15-16H2,1-3H3,(H,30,35)/t21-/m1/s1 | Definition date: | 2011-02-12 | Last modified: | 2011-06-04 | Identifier: | (2R)-4-(2,6-dimethoxypyrimidin-4-yl)-N-(4-methoxybenzyl)-1-{[4-(trifluoromethoxy)phenyl]sulfonyl}piperazine-2-carboxamide |
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![26S 26S](https://data.pdbj.org/pdbjplus/data/cc/svg/26S.svg) | 26S | Name: | (2R)-4-(2,6-dimethoxypyrimidin-4-yl)-1-[(4-ethylphenyl)sulfonyl]-N-(4-methoxybenzyl)piperazine-2-carboxamide | Formula: | C27 H33 N5 O6 S | SMILES: | O=S(=O)(c1ccc(cc1)CC)N4C(C(=O)NCc2ccc(OC)cc2)CN(c3nc(OC)nc(OC)c3)CC4 | InChi: | InChI=1S/C27H33N5O6S/c1-5-19-8-12-22(13-9-19)39(34,35)32-15-14-31(24-16-25(37-3)30-27(29-24)38-4)18-23(32)26(33)28-17-20-6-10-21(36-2)11-7-20/h6-13,16,23H,5,14-15,17-18H2,1-4H3,(H,28,33)/t23-/m1/s1 | Definition date: | 2011-02-12 | Last modified: | 2011-06-04 | Identifier: | (2R)-4-(2,6-dimethoxypyrimidin-4-yl)-1-[(4-ethylphenyl)sulfonyl]-N-(4-methoxybenzyl)piperazine-2-carboxamide |
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![272 272](https://data.pdbj.org/pdbjplus/data/cc/svg/272.svg) | 272 | Name: | 4-(6-HYDROXY-BENZO[D]ISOXAZOL-3-YL)BENZENE-1,3-DIOL | Formula: | C13 H9 N O4 | SMILES: | n2oc1cc(O)ccc1c2c3ccc(O)cc3O | InChi: | InChI=1S/C13H9NO4/c15-7-1-3-9(11(17)5-7)13-10-4-2-8(16)6-12(10)18-14-13/h1-6,15-17H | Definition date: | 2004-08-02 | Last modified: | 2011-06-04 | Identifier: | 4-(6-hydroxy-1,2-benzisoxazol-3-yl)benzene-1,3-diol |
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![276 276](https://data.pdbj.org/pdbjplus/data/cc/svg/276.svg) | 276 | Name: | 4-[[2-[[4-chloro-3-(trifluoromethyl)phenyl]amino]-3H-benzimidazol-5-yl]oxy]-N-methyl-pyridine-2-carboxamide | Formula: | C21 H15 Cl F3 N5 O2 | SMILES: | FC(F)(F)c1cc(ccc1Cl)Nc4nc3ccc(Oc2ccnc(C(=O)NC)c2)cc3n4 | InChi: | InChI=1S/C21H15ClF3N5O2/c1-26-19(31)18-10-13(6-7-27-18)32-12-3-5-16-17(9-12)30-20(29-16)28-11-2-4-15(22)14(8-11)21(23,24)25/h2-10H,1H3,(H,26,31)(H2,28,29,30) | Definition date: | 2007-08-09 | Last modified: | 2011-06-04 | Identifier: | 4-[(2-{[4-chloro-3-(trifluoromethyl)phenyl]amino}-1H-benzimidazol-6-yl)oxy]-N-methylpyridine-2-carboxamide |
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![279 279](https://data.pdbj.org/pdbjplus/data/cc/svg/279.svg) | 279 | Name: | N-ethyl-4-{[5-(methoxycarbamoyl)-2-methylphenyl]amino}-5-methylpyrrolo[2,1-f][1,2,4]triazine-6-carboxamide | Formula: | C19 H22 N6 O3 | SMILES: | O=C(NOC)c1cc(c(cc1)C)Nc2ncnn3c2c(c(c3)C(=O)NCC)C | InChi: | InChI=1S/C19H22N6O3/c1-5-20-19(27)14-9-25-16(12(14)3)17(21-10-22-25)23-15-8-13(7-6-11(15)2)18(26)24-28-4/h6-10H,5H2,1-4H3,(H,20,27)(H,24,26)(H,21,22,23) | Definition date: | 2007-10-25 | Last modified: | 2011-06-04 | Identifier: | N-ethyl-4-{[5-(methoxycarbamoyl)-2-methylphenyl]amino}-5-methylpyrrolo[2,1-f][1,2,4]triazine-6-carboxamide |
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![27A 27A](https://data.pdbj.org/pdbjplus/data/cc/svg/27A.svg) | 27A | Name: | (Z)-2-[2-(4-methylpiperazin-1-yl)benzyl]diazenecarbothioamide | Formula: | C13 H19 N5 S | SMILES: | S=C(/N=NCc2c(N1CCN(C)CC1)cccc2)N | InChi: | InChI=1S/C13H19N5S/c1-17-6-8-18(9-7-17)12-5-3-2-4-11(12)10-15-16-13(14)19/h2-5H,6-10H2,1H3,(H2,14,19)/b16-15- | Definition date: | 2009-03-27 | Last modified: | 2011-06-04 | Identifier: | (Z)-2-[2-(4-methylpiperazin-1-yl)benzyl]diazenecarbothioamide |
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![27P 27P](https://data.pdbj.org/pdbjplus/data/cc/svg/27P.svg) | 27P | Name: | 1-[2-(4-benzylphenoxy)ethyl]pyrrolidine | Formula: | C19 H23 N O | SMILES: | O(c1ccc(cc1)Cc2ccccc2)CCN3CCCC3 | InChi: | InChI=1S/C19H23NO/c1-2-6-17(7-3-1)16-18-8-10-19(11-9-18)21-15-14-20-12-4-5-13-20/h1-3,6-11H,4-5,12-16H2 | Definition date: | 2008-12-11 | Last modified: | 2011-06-04 | Identifier: | 1-[2-(4-benzylphenoxy)ethyl]pyrrolidine |
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![281 281](https://data.pdbj.org/pdbjplus/data/cc/svg/281.svg) | 281 | Name: | (2S)-2-[3-(AMINOMETHYL)PHENYL]-3-[(S)-{(1R)-1-[(2,1,3-BENZOTHIADIAZOL-4-YLSULFONYL)AMINO]-2-METHYLPROPYL}(HYDROXY)PHOSPHORYL]PROPANOIC ACID | Formula: | C20 H25 N4 O6 P S2 | SMILES: | O=C(O)C(c1cccc(c1)CN)CP(=O)(O)C(NS(=O)(=O)c2cccc3nsnc23)C(C)C | InChi: | InChI=1S/C20H25N4O6PS2/c1-12(2)19(24-33(29,30)17-8-4-7-16-18(17)23-32-22-16)31(27,28)11-15(20(25)26)14-6-3-5-13(9-14)10-21/h3-9,12,15,19,24H,10-11,21H2,1-2H3,(H,25,26)(H,27,28)/t15-,19+/m0/s1 | Definition date: | 2007-04-26 | Last modified: | 2011-06-04 | Identifier: | (2S)-2-[3-(aminomethyl)phenyl]-3-[(S)-{(1R)-1-[(2,1,3-benzothiadiazol-4-ylsulfonyl)amino]-2-methylpropyl}(hydroxy)phosphoryl]propanoic acid |
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![283 283](https://data.pdbj.org/pdbjplus/data/cc/svg/283.svg) | 283 | Name: | (3S)-1-{[4-(BUT-2-YN-1-YLOXY)PHENYL]SULFONYL}PYRROLIDINE-3-THIOL | Formula: | C14 H17 N O3 S2 | SMILES: | O=S(=O)(c1ccc(OCC#CC)cc1)N2CCC(S)C2 | InChi: | InChI=1S/C14H17NO3S2/c1-2-3-10-18-12-4-6-14(7-5-12)20(16,17)15-9-8-13(19)11-15/h4-7,13,19H,8-11H2,1H3/t13-/m0/s1 | Definition date: | 2007-02-09 | Last modified: | 2011-06-04 | Identifier: | (3S)-1-{[4-(but-2-yn-1-yloxy)phenyl]sulfonyl}pyrrolidine-3-thiol |
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![284 284](https://data.pdbj.org/pdbjplus/data/cc/svg/284.svg) | 284 | Name: | (4S)-4-methyl-1,4,5,6-tetrahydropyridin-2-amine | Formula: | C6 H12 N2 | SMILES: | NC1=CC(C)CCN1 | InChi: | InChI=1S/C6H12N2/c1-5-2-3-8-6(7)4-5/h4-5,8H,2-3,7H2,1H3/t5-/m0/s1 | Definition date: | 2007-10-24 | Last modified: | 2011-06-04 | Identifier: | (4S)-4-methyl-1,4,5,6-tetrahydropyridin-2-amine |
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![285 285](https://data.pdbj.org/pdbjplus/data/cc/svg/285.svg) | 285 | Name: | (2R,4R,5R)-2,4,5-trimethyl-1,3-oxazolidine | Formula: | C6 H13 N O | SMILES: | O1C(C)C(NC1C)C | InChi: | InChI=1S/C6H13NO/c1-4-5(2)8-6(3)7-4/h4-7H,1-3H3/t4-,5-,6-/m1/s1 | Definition date: | 2007-10-24 | Last modified: | 2011-06-04 | Identifier: | (2R,4R,5R)-2,4,5-trimethyl-1,3-oxazolidine |
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![287 287](https://data.pdbj.org/pdbjplus/data/cc/svg/287.svg) | 287 | Name: | 4-{[5-(methoxycarbamoyl)-2-methylphenyl]amino}-5-methyl-N-[(1S)-1-phenylethyl]pyrrolo[2,1-f][1,2,4]triazine-6-carboxamide | Formula: | C25 H26 N6 O3 | SMILES: | O=C(NOC)c1cc(c(cc1)C)Nc2ncnn3c2c(c(c3)C(=O)NC(c4ccccc4)C)C | InChi: | InChI=1S/C25H26N6O3/c1-15-10-11-19(24(32)30-34-4)12-21(15)29-23-22-16(2)20(13-31(22)27-14-26-23)25(33)28-17(3)18-8-6-5-7-9-18/h5-14,17H,1-4H3,(H,28,33)(H,30,32)(H,26,27,29)/t17-/m0/s1 | Definition date: | 2007-10-25 | Last modified: | 2011-06-04 | Identifier: | 4-{[5-(methoxycarbamoyl)-2-methylphenyl]amino}-5-methyl-N-[(1S)-1-phenylethyl]pyrrolo[2,1-f][1,2,4]triazine-6-carboxamide |
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![294 294](https://data.pdbj.org/pdbjplus/data/cc/svg/294.svg) | 294 | Name: | N-hydroxy-4-({4-[4-(trifluoromethyl)phenoxy]phenyl}sulfonyl)tetrahydro-2H-pyran-4-carboxamide | Formula: | C19 H18 F3 N O6 S | SMILES: | O=S(=O)(c2ccc(Oc1ccc(cc1)C(F)(F)F)cc2)C3(C(=O)NO)CCOCC3 | InChi: | InChI=1S/C19H18F3NO6S/c20-19(21,22)13-1-3-14(4-2-13)29-15-5-7-16(8-6-15)30(26,27)18(17(24)23-25)9-11-28-12-10-18/h1-8,25H,9-12H2,(H,23,24) | Definition date: | 2007-11-14 | Last modified: | 2011-06-04 | Identifier: | N-hydroxy-4-({4-[4-(trifluoromethyl)phenoxy]phenyl}sulfonyl)tetrahydro-2H-pyran-4-carboxamide |
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![295 295](https://data.pdbj.org/pdbjplus/data/cc/svg/295.svg) | 295 | Name: | (2S,3S)-3-(4-fluorophenyl)-2,3-dihydroxypropanoic acid | Formula: | C9 H9 F O4 | SMILES: | Fc1ccc(cc1)C(O)C(O)C(=O)O | InChi: | InChI=1S/C9H9FO4/c10-6-3-1-5(2-4-6)7(11)8(12)9(13)14/h1-4,7-8,11-12H,(H,13,14)/t7-,8-/m0/s1 | Definition date: | 2007-11-27 | Last modified: | 2011-06-04 | Identifier: | (2S,3S)-3-(4-fluorophenyl)-2,3-dihydroxypropanoic acid |
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![296 296](https://data.pdbj.org/pdbjplus/data/cc/svg/296.svg) | 296 | Name: | (3R)-3-amino-2,2-difluoro-3-(4-methoxyphenyl)propanoic acid | Formula: | C10 H11 F2 N O3 | SMILES: | O=C(O)C(F)(F)C(c1ccc(OC)cc1)N | InChi: | InChI=1S/C10H11F2NO3/c1-16-7-4-2-6(3-5-7)8(13)10(11,12)9(14)15/h2-5,8H,13H2,1H3,(H,14,15)/t8-/m1/s1 | Definition date: | 2007-11-27 | Last modified: | 2011-06-04 | Identifier: | (3R)-3-amino-2,2-difluoro-3-(4-methoxyphenyl)propanoic acid |
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![297 297](https://data.pdbj.org/pdbjplus/data/cc/svg/297.svg) | 297 | Name: | dodecane-1,12-diamine | Formula: | C12 H28 N2 | SMILES: | NCCCCCCCCCCCCN | InChi: | InChI=1S/C12H28N2/c13-11-9-7-5-3-1-2-4-6-8-10-12-14/h1-14H2 | Definition date: | 2007-12-05 | Last modified: | 2011-06-04 | Identifier: | dodecane-1,12-diamine |
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![298 298](https://data.pdbj.org/pdbjplus/data/cc/svg/298.svg) | 298 | Name: | N-[(1E,2Z)-but-2-en-1-ylidene]-N'-[(2E)-but-2-en-1-ylidene]butane-1,4-diamine | Formula: | C12 H20 N2 | SMILES: | N(=CC=CC)CCCC/N=C/C=CC | InChi: | InChI=1S/C12H20N2/c1-3-5-9-13-11-7-8-12-14-10-6-4-2/h3-6,9-10H,7-8,11-12H2,1-2H3/b5-3-,6-4+,13-9+,14-10? | Definition date: | 2007-12-05 | Last modified: | 2011-06-04 | Identifier: | N-[(1E,2Z)-but-2-en-1-ylidene]-N'-[(1Z,2E)-but-2-en-1-ylidene]butane-1,4-diamine |
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