 | | 130 | | Name: | 2-(2-HYDROXY-BIPHENYL)-1H-BENZOIMIDAZOLE-5-CARBOXAMIDINE | | Formula: | C20 H16 N4 O | | SMILES: | Oc4c(c1ccccc1)cccc4c3nc2cc(ccc2n3)C(=[N@H])N | | InChi: | InChI=1S/C20H16N4O/c21-19(22)13-9-10-16-17(11-13)24-20(23-16)15-8-4-7-14(18(15)25)12-5-2-1-3-6-12/h1-11,25H,(H3,21,22)(H,23,24) | | Definition date: | 2001-05-03 | | Last modified: | 2011-06-04 | | Identifier: | 2-(2-hydroxybiphenyl-3-yl)-1H-benzimidazole-5-carboximidamide |
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 | | 132 | | Name: | 6-CHLORO-2-(2-HYDROXY-BIPHENYL-3-YL)-1H-INDOLE-5-CARBOXAMIDINE | | Formula: | C21 H17 Cl N3 O | | SMILES: | Clc1c(cc2c(c1)nc(c2)c4cccc(c3ccccc3)c4O)C(=[NH2+])N | | InChi: | InChI=1S/C21H16ClN3O/c22-17-11-18-13(9-16(17)21(23)24)10-19(25-18)15-8-4-7-14(20(15)26)12-5-2-1-3-6-12/h1-11,25-26H,(H3,23,24)/p+1 | | Definition date: | 2001-05-04 | | Last modified: | 2011-06-04 | | Identifier: | amino[6-chloro-2-(2-hydroxybiphenyl-3-yl)-1H-indol-5-yl]methaniminium |
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 | | 134 | | Name: | 6-FLUORO-2-[2-HYDROXY-3-(2-METHYL-CYCLOHEXYLOXY)-PHENYL]-1H-INDOLE-5-CARBOXAMIDINE | | Formula: | C22 H24 F N3 O2 | | SMILES: | Fc1c(cc2c(c1)nc(c2)c4cccc(OC3CCCCC3C)c4O)C(=[N@H])N | | InChi: | InChI=1S/C22H24FN3O2/c1-12-5-2-3-7-19(12)28-20-8-4-6-14(21(20)27)18-10-13-9-15(22(24)25)16(23)11-17(13)26-18/h4,6,8-12,19,26-27H,2-3,5,7H2,1H3,(H3,24,25)/t12-,19-/m0/s1 | | Definition date: | 2001-05-09 | | Last modified: | 2011-06-04 | | Identifier: | 6-fluoro-2-(2-hydroxy-3-{[(1S,2S)-2-methylcyclohexyl]oxy}phenyl)-1H-indole-5-carboximidamide |
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 | | 135 | | Name: | N-(4-CARBAMIMIDOYL-PHENYL)-2-HYDROXY-BENZAMIDE | | Formula: | C14 H13 N3 O2 | | SMILES: | O=C(c1ccccc1O)Nc2ccc(C(=[N@H])N)cc2 | | InChi: | InChI=1S/C14H13N3O2/c15-13(16)9-5-7-10(8-6-9)17-14(19)11-3-1-2-4-12(11)18/h1-8,18H,(H3,15,16)(H,17,19) | | Definition date: | 2001-05-09 | | Last modified: | 2011-06-04 | | Identifier: | N-(4-carbamimidoylphenyl)-2-hydroxybenzamide |
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 | | NOW | | Name: | Nalpha-[(3-tert-butyl-1-methyl-1H-pyrazol-5-yl)carbonyl]-N-[(2Z)-2-iminoethyl]-3-methyl-L-phenylalaninamide | | Formula: | C21 H29 N5 O2 | | SMILES: | O=C(c1cc(nn1C)C(C)(C)C)NC(C(=O)NCC=[N@H])Cc2cccc(c2)C | | InChi: | InChI=1S/C21H29N5O2/c1-14-7-6-8-15(11-14)12-16(19(27)23-10-9-22)24-20(28)17-13-18(21(2,3)4)25-26(17)5/h6-9,11,13,16,22H,10,12H2,1-5H3,(H,23,27)(H,24,28)/b22-9+/t16-/m0/s1 | | Definition date: | 2009-05-22 | | Last modified: | 2011-06-04 | | Identifier: | Nalpha-[(3-tert-butyl-1-methyl-1H-pyrazol-5-yl)carbonyl]-N-[(2Z)-2-iminoethyl]-3-methyl-L-phenylalaninamide |
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 | | 137 | | Name: | 1-(O-CARBOXY-PHENYLAMINO)-1-DEOXY-D-RIBULOSE-5-PHOSPHATE | | Formula: | C12 H18 N O9 P | | SMILES: | O=P(O)(O)OCC(O)C(O)C(O)CNc1ccccc1C(=O)O | | InChi: | InChI=1S/C12H18NO9P/c14-9(11(16)10(15)6-22-23(19,20)21)5-13-8-4-2-1-3-7(8)12(17)18/h1-4,9-11,13-16H,5-6H2,(H,17,18)(H2,19,20,21)/t9-,10-,11+/m1/s1 | | Definition date: | 2001-06-14 | | Last modified: | 2011-06-04 | | Identifier: | 1-[(2-carboxyphenyl)amino]-1-deoxy-5-O-phosphono-D-arabinitol |
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 | | 138 | | Name: | N-[5'-O-PHOSPHONO-RIBOFURANOSYL]-2-[2-HYDROXY-2-[4-[GLUTAMIC ACID]-N-CARBONYLPHENYL]-3-[2-AMINO-4-HYDROXY-QUINAZOLIN-6-YL]-PROPANYLAMINO]-ACETAMIDE | | Formula: | C30 H37 N6 O15 P | | SMILES: | O=C(NC1OC(C(O)C1O)COP(=O)(O)O)CNCC(O)(c2ccc(C(=O)NC(C(=O)O)CCC(=O)O)cc2)Cc4cc3c(O)nc(nc3cc4)N | | InChi: | InChI=1S/C30H37N6O15P/c31-29-34-18-6-1-14(9-17(18)26(43)36-29)10-30(46,16-4-2-15(3-5-16)25(42)33-19(28(44)45)7-8-22(38)39)13-32-11-21(37)35-27-24(41)23(40)20(51-27)12-50-52(47,48)49/h1-6,9,19-20,23-24,27,32,40-41,46H,7-8,10-13H2,(H,33,42)(H,35,37)(H,38,39)(H,44,45)(H2,47,48,49)(H3,31,34,36,43)/t19-,20+,23+,24+,27+,30+/m0/s1 | | Definition date: | 2001-07-23 | | Last modified: | 2011-06-04 | | Identifier: | (2S)-2-[({4-[(1S)-2-(2-amino-4-hydroxyquinazolin-6-yl)-1-({[2-({(2R,3R,4S,5R)-3,4-dihydroxy-5-[(phosphonooxy)methyl]tetrahydrofuran-2-yl}amino)-2-oxoethyl]amino}methyl)-1-hydroxyethyl]phenyl}carbonyl)amino]pentanedioic acid (non-preferred name) |
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 | | 139 | | Name: | ADENOSINE-5'-[TRIHYDROGEN DIPHOSPHATE] P'-3'-ESTER WITH 2'-DEOXYURIDINE | | Formula: | C19 H25 N7 O14 P2 | | SMILES: | O=C1C=CN(C(=O)N1)C5OC(CO)C(OP(=O)(O)OP(=O)(O)OCC4OC(n3cnc2c(ncnc23)N)C(O)C4O)C5 | | InChi: | InChI=1S/C19H25N7O14P2/c20-16-13-17(22-6-21-16)26(7-23-13)18-15(30)14(29)10(38-18)5-36-41(32,33)40-42(34,35)39-8-3-12(37-9(8)4-27)25-2-1-11(28)24-19(25)31/h1-2,6-10,12,14-15,18,27,29-30H,3-5H2,(H,32,33)(H,34,35)(H2,20,21,22)(H,24,28,31)/t8-,9+,10+,12+,14+,15+,18+/m0/s1 | | Definition date: | 2001-07-30 | | Last modified: | 2011-06-04 | | Identifier: | [(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl (2R,3S,5R)-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-2-(hydroxymethyl)tetrahydrofuran-3-yl dihydrogen diphosphate (non-preferred name) |
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 | | NP2 | | Name: | N-(3-AMINOPROPYL)-2-NITROBENZENAMINE | | Formula: | C9 H13 N3 O2 | | SMILES: | [O-][N+](=O)c1ccccc1NCCCN | | InChi: | InChI=1S/C9H13N3O2/c10-6-3-7-11-8-4-1-2-5-9(8)12(13)14/h1-2,4-5,11H,3,6-7,10H2 | | Definition date: | 2005-01-17 | | Last modified: | 2011-06-04 | | Identifier: | N-(2-nitrophenyl)propane-1,3-diamine |
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 | | 13D | | Name: | 1,3-DIAMINOPROPANE | | Formula: | C3 H10 N2 | | SMILES: | NCCCN | | InChi: | InChI=1S/C3H10N2/c4-2-1-3-5/h1-5H2 | | Definition date: | 2005-04-04 | | Last modified: | 2011-06-04 | | Identifier: | propane-1,3-diamine |
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 | | NP3 | | Name: | 1-[2-DEOXY-RIBOFURANOSYL]-1H-[3-NITRO-PYRROL]-5'-PHOSPHATE | | Formula: | C9 H13 N2 O8 P | | SMILES: | [O-][N+](=O)c1ccn(c1)C2OC(C(O)C2)COP(=O)(O)O | | InChi: | InChI=1S/C9H13N2O8P/c12-7-3-9(10-2-1-6(4-10)11(13)14)19-8(7)5-18-20(15,16)17/h1-2,4,7-9,12H,3,5H2,(H2,15,16,17)/t7-,8+,9+/m0/s1 | | Definition date: | 1999-12-20 | | Last modified: | 2011-06-04 | | Identifier: | 1-(2-deoxy-5-O-phosphono-beta-D-erythro-pentofuranosyl)-3-nitro-1H-pyrrole |
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 | | NP4 | | Name: | (5Z)-12-CHLORO-13,15-DIHYDROXY-4,7,8,9-TETRAHYDRO-2-BENZOXACYCLOTRIDECINE-1,10(3H,11H)-DIONE | | Formula: | C16 H17 Cl O5 | | SMILES: | O=C1OCCC=CCCCC(=O)Cc2c1c(O)cc(O)c2Cl | | InChi: | InChI=1S/C16H17ClO5/c17-15-11-8-10(18)6-4-2-1-3-5-7-22-16(21)14(11)12(19)9-13(15)20/h1,3,9,19-20H,2,4-8H2/b3-1- | | Definition date: | 2006-07-04 | | Last modified: | 2011-06-04 | | Identifier: | (5Z)-12-chloro-13,15-dihydroxy-4,7,8,9-tetrahydro-2-benzoxacyclotridecine-1,10(3H,11H)-dione |
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 | | NP5 | | Name: | (5E)-12-CHLORO-13,15-DIHYDROXY-4,7,8,9-TETRAHYDRO-2-BENZOXACYCLOTRIDECINE-1,10(3H,11H)-DIONE | | Formula: | C16 H17 Cl O5 | | SMILES: | O=C1OCCC=CCCCC(=O)Cc2c1c(O)cc(O)c2Cl | | InChi: | InChI=1S/C16H17ClO5/c17-15-11-8-10(18)6-4-2-1-3-5-7-22-16(21)14(11)12(19)9-13(15)20/h1,3,9,19-20H,2,4-8H2/b3-1+ | | Definition date: | 2006-07-04 | | Last modified: | 2011-06-04 | | Identifier: | (5E)-12-chloro-13,15-dihydroxy-4,7,8,9-tetrahydro-2-benzoxacyclotridecine-1,10(3H,11H)-dione |
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 | | NP6 | | Name: | [[(3R,4R,5S,6R)-3-(BUTANOYLAMINO)-4,5-DIHYDROXY-6-(HYDROXYMETHYL)OXAN-2-YLIDENE]AMINO] N-PHENYLCARBAMATE | | Formula: | C17 H23 N3 O7 | | SMILES: | O=C(ON=C1/OC(CO)C(O)C(O)C1NC(=O)CCC)Nc2ccccc2 | | InChi: | InChI=1S/C17H23N3O7/c1-2-6-12(22)19-13-15(24)14(23)11(9-21)26-16(13)20-27-17(25)18-10-7-4-3-5-8-10/h3-5,7-8,11,13-15,21,23-24H,2,6,9H2,1H3,(H,18,25)(H,19,22)/b20-16-/t11-,13-,14-,15-/m1/s1 | | Definition date: | 2009-03-10 | | Last modified: | 2011-06-04 | | Identifier: | N-[(2Z,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-{[(phenylcarbamoyl)oxy]imino}tetrahydro-2H-pyran-3-yl]butanamide (non-preferred name) |
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 | | NPA | | Name: | 2-(4-HYDROXY-3-NITROPHENYL)ACETIC ACID | | Formula: | C8 H7 N O5 | | SMILES: | O=[N+]([O-])c1cc(ccc1O)CC(=O)O | | InChi: | InChI=1S/C8H7NO5/c10-7-2-1-5(4-8(11)12)3-6(7)9(13)14/h1-3,10H,4H2,(H,11,12) | | Definition date: | 1999-07-08 | | Last modified: | 2011-06-04 | | Identifier: | (4-hydroxy-3-nitrophenyl)acetic acid |
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 | | NPB | | Name: | 3-NITROPHENYLBORONIC ACID | | Formula: | C6 H6 B N O4 | | SMILES: | [O-][N+](=O)c1cc(B(O)O)ccc1 | | InChi: | InChI=1S/C6H6BNO4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4,9-10H | | Definition date: | 2001-11-19 | | Last modified: | 2011-06-04 | | Identifier: | (3-nitrophenyl)boronic acid |
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 | | NPG | | Name: | N-SUCCINYL PHENYLGLYCINE | | Formula: | C12 H13 N O5 | | SMILES: | O=C(O)CCC(=O)NC(C(=O)O)c1ccccc1 | | InChi: | InChI=1S/C12H13NO5/c14-9(6-7-10(15)16)13-11(12(17)18)8-4-2-1-3-5-8/h1-5,11H,6-7H2,(H,13,14)(H,15,16)(H,17,18)/t11-/m1/s1 | | Definition date: | 2004-03-04 | | Last modified: | 2011-06-04 | | Identifier: | 4-{[(R)-carboxy(phenyl)methyl]amino}-4-oxobutanoic acid |
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 | | NPH | | Name: | CYSTEINE-METHYLENE-CARBAMOYL-1,10-PHENANTHROLINE | | Formula: | C17 H16 N4 O3 S | | SMILES: | O=C(O)C(N)CSCC(=O)Nc2cc1cccnc1c3ncccc23 | | InChi: | InChI=1S/C17H16N4O3S/c18-12(17(23)24)8-25-9-14(22)21-13-7-10-3-1-5-19-15(10)16-11(13)4-2-6-20-16/h1-7,12H,8-9,18H2,(H,21,22)(H,23,24)/t12-/m0/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2011-06-04 | | Identifier: | S-[2-oxo-2-(1,10-phenanthrolin-5-ylamino)ethyl]-L-cysteine |
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 | | 13Z | | Name: | 2-[(2-{(2S,4S)-2-[(R)-(5-tert-butyl-1,3,4-oxadiazol-2-yl)(hydroxy)methyl]-4-fluoropyrrolidin-1-yl}-2-oxoethyl)amino]-2-methylpropan-1-ol | | Formula: | C17 H29 F N4 O4 | | SMILES: | FC1CC(N(C(=O)CNC(C)(C)CO)C1)C(O)c2nnc(o2)C(C)(C)C | | InChi: | InChI=1S/C17H29FN4O4/c1-16(2,3)15-21-20-14(26-15)13(25)11-6-10(18)8-22(11)12(24)7-19-17(4,5)9-23/h10-11,13,19,23,25H,6-9H2,1-5H3/t10-,11-,13+/m0/s1 | | Definition date: | 2008-02-12 | | Last modified: | 2011-06-04 | | Identifier: | 2-[(2-{(2S,4S)-2-[(R)-(5-tert-butyl-1,3,4-oxadiazol-2-yl)(hydroxy)methyl]-4-fluoropyrrolidin-1-yl}-2-oxoethyl)amino]-2-methylpropan-1-ol |
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 | | NPV | | Name: | 4-[8-(3-nitrophenyl)-1,7-naphthyridin-6-yl]benzoic acid | | Formula: | C21 H13 N3 O4 | | SMILES: | [O-][N+](=O)c1cccc(c1)c3nc(cc2c3nccc2)c4ccc(C(=O)O)cc4 | | InChi: | InChI=1S/C21H13N3O4/c25-21(26)14-8-6-13(7-9-14)18-12-16-4-2-10-22-19(16)20(23-18)15-3-1-5-17(11-15)24(27)28/h1-12H,(H,25,26) | | Definition date: | 2007-09-06 | | Last modified: | 2011-06-04 | | Identifier: | 4-[8-(3-nitrophenyl)-1,7-naphthyridin-6-yl]benzoic acid |
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 | | NPY | | Name: | NAPHTHALENE | | Formula: | C10 H8 | | SMILES: | c12ccccc1cccc2 | | InChi: | InChI=1S/C10H8/c1-2-6-10-8-4-3-7-9(10)5-1/h1-8H | | Definition date: | 1999-07-08 | | Last modified: | 2011-06-04 | | Identifier: | naphthalene |
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 | | 14C | | Name: | 2-(2-chloropyridin-4-yl)-4-methyl-1H-isoindole-1,3(2H)-dione | | Formula: | C14 H9 Cl N2 O2 | | SMILES: | Clc1nccc(c1)N3C(=O)c2cccc(c2C3=O)C | | InChi: | InChI=1S/C14H9ClN2O2/c1-8-3-2-4-10-12(8)14(19)17(13(10)18)9-5-6-16-11(15)7-9/h2-7H,1H3 | | Definition date: | 2008-01-21 | | Last modified: | 2011-06-04 | | Identifier: | 2-(2-chloropyridin-4-yl)-4-methyl-1H-isoindole-1,3(2H)-dione |
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 | | 14H | | Name: | N-[(1R,3R)-3-hydroxy-1-(hydroxymethyl)-3-phenylpropyl]tetradecanamide | | Formula: | C24 H41 N O3 | | SMILES: | O=C(NC(CC(O)c1ccccc1)CO)CCCCCCCCCCCCC | | InChi: | InChI=1S/C24H41NO3/c1-2-3-4-5-6-7-8-9-10-11-15-18-24(28)25-22(20-26)19-23(27)21-16-13-12-14-17-21/h12-14,16-17,22-23,26-27H,2-11,15,18-20H2,1H3,(H,25,28)/t22-,23-/m1/s1 | | Definition date: | 2009-04-22 | | Last modified: | 2011-06-04 | | Identifier: | N-[(1R,3R)-3-hydroxy-1-(hydroxymethyl)-3-phenylpropyl]tetradecanamide |
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 | | 14I | | Name: | naphtho[2,1-b:7,8-b']difuran-2,9-dicarboxylic acid | | Formula: | C16 H8 O6 | | SMILES: | O=C(O)c4oc1c(c3c(cc1)ccc2oc(cc23)C(=O)O)c4 | | InChi: | InChI=1S/C16H8O6/c17-15(18)12-5-8-10(21-12)3-1-7-2-4-11-9(14(7)8)6-13(22-11)16(19)20/h1-6H,(H,17,18)(H,19,20) | | Definition date: | 2010-03-26 | | Last modified: | 2011-06-04 | | Identifier: | naphtho[2,1-b:7,8-b']difuran-2,9-dicarboxylic acid |
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 | | 14O | | Name: | 5-fluoro-1H-indole | | Formula: | C8 H6 F N | | SMILES: | Fc1cc2c(cc1)ncc2 | | InChi: | InChI=1S/C8H6FN/c9-7-1-2-8-6(5-7)3-4-10-8/h1-5,10H | | Definition date: | 2009-01-20 | | Last modified: | 2011-06-04 | | Identifier: | 5-fluoro-1H-indole |
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