 | | W5R | | Name: | dimethyl 2,6-bis[2-(dimethylamino)ethyl]-1-methyl-4-[4-(trifluoromethyl)phenyl]-4~{H}-pyridine-3,5-dicarboxylate | | Formula: | C25 H34 F3 N3 O4 | | SMILES: | COC(=O)C1=C(CCN(C)C)N(C)C(=C(C1c2ccc(cc2)C(F)(F)F)C(=O)OC)CCN(C)C | | InChi: | InChI=1S/C25H34F3N3O4/c1-29(2)14-12-18-21(23(32)34-6)20(16-8-10-17(11-9-16)25(26,27)28)22(24(33)35-7)19(31(18)5)13-15-30(3)4/h8-11,20H,12-15H2,1-7H3 | | Definition date: | 2023-05-03 | | Last modified: | 2023-07-07 | | Release date: | 2023-07-12 | | Identifier: | dimethyl 2,6-bis[2-(dimethylamino)ethyl]-1-methyl-4-[4-(trifluoromethyl)phenyl]-4~{H}-pyridine-3,5-dicarboxylate |
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 | | Z1L | | Name: | 1-anilinocyclopropane-1-carboxylic acid | | Formula: | C10 H11 N O2 | | SMILES: | O=C(O)C1(Nc2ccccc2)CC1 | | InChi: | InChI=1S/C10H11NO2/c12-9(13)10(6-7-10)11-8-4-2-1-3-5-8/h1-5,11H,6-7H2,(H,12,13) | | Definition date: | 2023-06-22 | | Last modified: | 2023-07-07 | | Release date: | 2023-07-12 | | Identifier: | 1-anilinocyclopropane-1-carboxylic acid |
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 | | Z2Z | | Name: | 8-(methanesulfonyl)quinoline | | Formula: | C10 H9 N O2 S | | SMILES: | CS(=O)(=O)c1cccc2cccnc12 | | InChi: | InChI=1S/C10H9NO2S/c1-14(12,13)9-6-2-4-8-5-3-7-11-10(8)9/h2-7H,1H3 | | Definition date: | 2023-06-22 | | Last modified: | 2023-07-07 | | Release date: | 2023-07-12 | | Identifier: | 8-(methanesulfonyl)quinoline |
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 | | Z3H | | Name: | N-[(4R)-3,4-dihydro-2H-1-benzopyran-4-yl]methanesulfonamide | | Formula: | C10 H13 N O3 S | | SMILES: | CS(=O)(=O)NC1CCOc2ccccc21 | | InChi: | InChI=1S/C10H13NO3S/c1-15(12,13)11-9-6-7-14-10-5-3-2-4-8(9)10/h2-5,9,11H,6-7H2,1H3/t9-/m1/s1 | | Definition date: | 2023-06-22 | | Last modified: | 2023-07-07 | | Release date: | 2023-07-12 | | Identifier: | N-[(4R)-3,4-dihydro-2H-1-benzopyran-4-yl]methanesulfonamide |
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 | | UU0 | | Name: | 9,11-epoxy-17-hydroxypregn-4-ene-3,20-dione actate | | Formula: | C24 H32 O6 | | SMILES: | C[CH]1C[CH]2[CH]3CCC4=CC(=O)CC[C]4(C)[C]35O[CH]5C[C]2(C)[C]1(O)C(=O)COC(C)=O | | InChi: | InChI=1S/C24H32O6/c1-13-9-18-17-6-5-15-10-16(26)7-8-21(15,3)24(17)20(30-24)11-22(18,4)23(13,28)19(27)12-29-14(2)25/h10,13,17-18,20,28H,5-9,11-12H2,1-4H3/t13-,17+,18-,20+,21+,22+,23+,24-/m1/s1 | | Definition date: | 2023-06-22 | | Last modified: | 2023-07-07 | | Release date: | 2023-07-12 |
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 | | Z3O | | Name: | (3S)-3-{[(4R)-4-methyl-3,4-dihydropyridin-1(2H)-yl]methyl}-3H-indole | | Formula: | C15 H18 N2 | | SMILES: | CC1C=CN(CC2C=Nc3ccccc23)CC1 | | InChi: | InChI=1S/C15H18N2/c1-12-6-8-17(9-7-12)11-13-10-16-15-5-3-2-4-14(13)15/h2-6,8,10,12-13H,7,9,11H2,1H3/t12-,13+/m0/s1 | | Definition date: | 2023-06-22 | | Last modified: | 2023-07-07 | | Release date: | 2023-07-12 | | Identifier: | (3S)-3-{[(4R)-4-methyl-3,4-dihydropyridin-1(2H)-yl]methyl}-3H-indole |
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 | | Z4X | | Name: | 2-ethoxy-3-fluoro-N,N-dimethylbenzamide | | Formula: | C11 H14 F N O2 | | SMILES: | CCOc1c(cccc1F)C(=O)N(C)C | | InChi: | InChI=1S/C11H14FNO2/c1-4-15-10-8(11(14)13(2)3)6-5-7-9(10)12/h5-7H,4H2,1-3H3 | | Definition date: | 2023-06-22 | | Last modified: | 2023-07-07 | | Release date: | 2023-07-12 | | Identifier: | 2-ethoxy-3-fluoro-N,N-dimethylbenzamide |
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 | | Z5C | | Name: | 5-(methoxymethyl)-1,2-oxazole-3-carboxamide | | Formula: | C6 H8 N2 O3 | | SMILES: | O=C(N)c1cc(COC)on1 | | InChi: | InChI=1S/C6H8N2O3/c1-10-3-4-2-5(6(7)9)8-11-4/h2H,3H2,1H3,(H2,7,9) | | Definition date: | 2023-06-22 | | Last modified: | 2023-07-07 | | Release date: | 2023-07-12 | | Identifier: | 5-(methoxymethyl)-1,2-oxazole-3-carboxamide |
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 | | Z5Z | | Name: | (2R,6S)-2,6-dimethyl-4-(3-methyl-1,2,4-thiadiazol-5-yl)morpholine | | Formula: | C9 H15 N3 O S | | SMILES: | Cc1nc(sn1)N1CC(C)OC(C)C1 | | InChi: | InChI=1S/C9H15N3OS/c1-6-4-12(5-7(2)13-6)9-10-8(3)11-14-9/h6-7H,4-5H2,1-3H3/t6-,7+ | | Definition date: | 2023-06-22 | | Last modified: | 2023-07-07 | | Release date: | 2023-07-12 | | Identifier: | (2R,6S)-2,6-dimethyl-4-(3-methyl-1,2,4-thiadiazol-5-yl)morpholine |
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 | | ZRR | | Name: | (5P)-3-({(8R)-5-[(4-aminopiperidin-1-yl)methyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl}amino)-5-[2-(propan-2-yl)-2H-tetrazol-5-yl]phenol | | Formula: | C22 H28 N10 O | | SMILES: | CC(C)n1nc(nn1)c1cc(O)cc(Nc2ncnn3ccc(CN4CCC(N)CC4)c32)c1 | | InChi: | InChI=1S/C22H28N10O/c1-14(2)32-28-21(27-29-32)16-9-18(11-19(33)10-16)26-22-20-15(3-8-31(20)25-13-24-22)12-30-6-4-17(23)5-7-30/h3,8-11,13-14,17,33H,4-7,12,23H2,1-2H3,(H,24,25,26) | | Definition date: | 2023-03-27 | | Last modified: | 2023-07-07 | | Release date: | 2023-07-12 | | Identifier: | (5P)-3-({(8R)-5-[(4-aminopiperidin-1-yl)methyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl}amino)-5-[2-(propan-2-yl)-2H-tetrazol-5-yl]phenol |
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 | | S2F | | Name: | (~{Z})-7-[(1~{R},2~{R},3~{R},5~{S})-2-[(~{E})-3,3-bis(fluoranyl)-4-phenoxy-but-1-enyl]-3,5-bis(oxidanyl)cyclopentyl]hept-5-enoic acid | | Formula: | C22 H28 F2 O5 | | SMILES: | O[CH]1C[CH](O)[CH](C=CC(F)(F)COc2ccccc2)[CH]1CC=CCCCC(O)=O | | InChi: | InChI=1S/C22H28F2O5/c23-22(24,15-29-16-8-4-3-5-9-16)13-12-18-17(19(25)14-20(18)26)10-6-1-2-7-11-21(27)28/h1,3-6,8-9,12-13,17-20,25-26H,2,7,10-11,14-15H2,(H,27,28)/b6-1-,13-12+/t17-,18-,19+,20-/m1/s1 | | Synonyms: | Tafluprost acid | | Definition date: | 2023-04-08 | | Last modified: | 2023-07-07 | | Release date: | 2023-07-12 | | Identifier: | (~{Z})-7-[(1~{R},2~{R},3~{R},5~{S})-2-[(~{E})-3,3-bis(fluoranyl)-4-phenoxy-but-1-enyl]-3,5-bis(oxidanyl)cyclopentyl]hept-5-enoic acid |
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 | | Z9I | | Name: | 1-[(2R)-1-(methanesulfonyl)pyrrolidin-2-yl]methanamine | | Formula: | C6 H14 N2 O2 S | | SMILES: | NCC1CCCN1S(=O)(C)=O | | InChi: | InChI=1S/C6H14N2O2S/c1-11(9,10)8-4-2-3-6(8)5-7/h6H,2-5,7H2,1H3/t6-/m1/s1 | | Definition date: | 2023-06-23 | | Last modified: | 2023-07-07 | | Release date: | 2023-07-12 | | Identifier: | 1-[(2R)-1-(methanesulfonyl)pyrrolidin-2-yl]methanamine |
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 | | ZA9 | | Name: | 4-[(3S)-piperidin-3-yl]-1H-indole | | Formula: | C13 H16 N2 | | SMILES: | c1c[NH]c2cccc(c12)C1CCCNC1 | | InChi: | InChI=1S/C13H16N2/c1-4-11(10-3-2-7-14-9-10)12-6-8-15-13(12)5-1/h1,4-6,8,10,14-15H,2-3,7,9H2/t10-/m1/s1 | | Definition date: | 2023-06-23 | | Last modified: | 2023-07-07 | | Release date: | 2023-07-12 | | Identifier: | 4-[(3S)-piperidin-3-yl]-1H-indole |
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 | | XPW | | Name: | 1-({(5S,7S)-3-[5-(2-hydroxypropan-2-yl)pyrazin-2-yl]-7-methyl-2-oxo-1-oxa-3-azaspiro[4.5]decan-7-yl}methyl)-1H-benzimidazole-6-carbonitrile | | Formula: | C25 H28 N6 O3 | | SMILES: | CC(C)(O)c1ncc(nc1)N1CC2(CCCC(C)(Cn3cnc4ccc(C#N)cc43)C2)OC1=O | | InChi: | InChI=1S/C25H28N6O3/c1-23(2,33)20-11-28-21(12-27-20)31-15-25(34-22(31)32)8-4-7-24(3,13-25)14-30-16-29-18-6-5-17(10-26)9-19(18)30/h5-6,9,11-12,16,33H,4,7-8,13-15H2,1-3H3/t24-,25-/m0/s1 | | Synonyms: | GSK2798745 | | Definition date: | 2022-12-05 | | Last modified: | 2023-07-07 | | Release date: | 2023-07-12 | | Identifier: | 1-({(5S,7S)-3-[5-(2-hydroxypropan-2-yl)pyrazin-2-yl]-7-methyl-2-oxo-1-oxa-3-azaspiro[4.5]decan-7-yl}methyl)-1H-benzimidazole-6-carbonitrile |
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 | | XQ3 | | Name: | N-[(2S)-1-{4-[N-(2,4-dichlorobenzene-1-sulfonyl)-L-seryl]piperazin-1-yl}-4-methyl-1-oxopentan-2-yl]-1-benzothiophene-2-carboxamide | | Formula: | C28 H32 Cl2 N4 O6 S2 | | SMILES: | Clc1ccc(c(Cl)c1)S(=O)(=O)NC(CO)C(=O)N1CCN(CC1)C(=O)C(CC(C)C)NC(=O)c1cc2ccccc2s1 | | InChi: | InChI=1S/C28H32Cl2N4O6S2/c1-17(2)13-21(31-26(36)24-14-18-5-3-4-6-23(18)41-24)27(37)33-9-11-34(12-10-33)28(38)22(16-35)32-42(39,40)25-8-7-19(29)15-20(25)30/h3-8,14-15,17,21-22,32,35H,9-13,16H2,1-2H3,(H,31,36)/t21-,22-/m0/s1 | | Synonyms: | GSK1016790A | | Definition date: | 2022-12-05 | | Last modified: | 2023-07-07 | | Release date: | 2023-07-12 | | Identifier: | N-[(2S)-1-{4-[N-(2,4-dichlorobenzene-1-sulfonyl)-L-seryl]piperazin-1-yl}-4-methyl-1-oxopentan-2-yl]-1-benzothiophene-2-carboxamide |
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 | | ZBH | | Name: | (4S)-N,2-dimethyl-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxamide | | Formula: | C10 H14 N2 O S | | SMILES: | CNC(=O)C1CCCc2sc(C)nc21 | | InChi: | InChI=1S/C10H14N2OS/c1-6-12-9-7(10(13)11-2)4-3-5-8(9)14-6/h7H,3-5H2,1-2H3,(H,11,13)/t7-/m0/s1 | | Definition date: | 2023-06-23 | | Last modified: | 2023-07-07 | | Release date: | 2023-07-12 | | Identifier: | (4S)-N,2-dimethyl-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxamide |
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 | | XQU | | Name: | nitrosochloramphenicol | | Formula: | C11 H14 Cl2 N2 O4 | | SMILES: | ONc1ccc(cc1)C(O)C(CO)NC(=O)C(Cl)Cl | | InChi: | InChI=1S/C11H14Cl2N2O4/c12-10(13)11(18)14-8(5-16)9(17)6-1-3-7(15-19)4-2-6/h1-4,8-10,15-17,19H,5H2,(H,14,18)/t8-,9-/m1/s1 | | Synonyms: | 2,2-dichloro-N-{(1R,2R)-1,3-dihydroxy-1-[4-(hydroxyamino)phenyl]propan-2-yl}acetamide | | Definition date: | 2022-12-05 | | Last modified: | 2023-07-07 | | Release date: | 2023-07-12 | | Identifier: | 2,2-dichloro-N-{(1R,2R)-1,3-dihydroxy-1-[4-(hydroxyamino)phenyl]propan-2-yl}acetamide |
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 | | ZDL | | Name: | 1,3-dimethylimidazolidine | | Formula: | C5 H12 N2 | | SMILES: | CN1CCN(C)C1 | | InChi: | InChI=1S/C5H12N2/c1-6-3-4-7(2)5-6/h3-5H2,1-2H3 | | Definition date: | 2023-06-23 | | Last modified: | 2023-07-07 | | Release date: | 2023-07-12 | | Identifier: | 1,3-dimethylimidazolidine |
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 | | ZE9 | | Name: | 1-[(3R,5R)-5-(furan-2-yl)-3-(5-methylfuran-2-yl)pyrazolidin-1-yl]ethan-1-one | | Formula: | C14 H16 N2 O3 | | SMILES: | CC(=O)N1NC(CC1c1ccco1)c1ccc(C)o1 | | InChi: | InChI=1S/C14H16N2O3/c1-9-5-6-13(19-9)11-8-12(14-4-3-7-18-14)16(15-11)10(2)17/h3-7,11-12,15H,8H2,1-2H3/t11-,12-/m1/s1 | | Definition date: | 2023-06-23 | | Last modified: | 2023-07-07 | | Release date: | 2023-07-12 | | Identifier: | 1-[(3R,5R)-5-(furan-2-yl)-3-(5-methylfuran-2-yl)pyrazolidin-1-yl]ethan-1-one |
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 | | ZEK | | Name: | 3-acetamido-N-methylbenzamide | | Formula: | C10 H12 N2 O2 | | SMILES: | O=C(C)Nc1cc(ccc1)C(=O)NC | | InChi: | InChI=1S/C10H12N2O2/c1-7(13)12-9-5-3-4-8(6-9)10(14)11-2/h3-6H,1-2H3,(H,11,14)(H,12,13) | | Definition date: | 2023-06-23 | | Last modified: | 2023-07-07 | | Release date: | 2023-07-12 | | Identifier: | 3-acetamido-N-methylbenzamide |
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 | | ZFI | | Name: | N-[2-(methanesulfonyl)phenyl]acetamide | | Formula: | C9 H11 N O3 S | | SMILES: | O=S(C)(=O)c1ccccc1NC(C)=O | | InChi: | InChI=1S/C9H11NO3S/c1-7(11)10-8-5-3-4-6-9(8)14(2,12)13/h3-6H,1-2H3,(H,10,11) | | Definition date: | 2023-06-23 | | Last modified: | 2023-07-07 | | Release date: | 2023-07-12 | | Identifier: | N-[2-(methanesulfonyl)phenyl]acetamide |
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 | | ZG0 | | Name: | N-(3-methylphenyl)acetamide | | Formula: | C9 H11 N O | | SMILES: | O=C(C)Nc1cc(C)ccc1 | | InChi: | InChI=1S/C9H11NO/c1-7-4-3-5-9(6-7)10-8(2)11/h3-6H,1-2H3,(H,10,11) | | Definition date: | 2023-06-23 | | Last modified: | 2023-07-07 | | Release date: | 2023-07-12 | | Identifier: | N-(3-methylphenyl)acetamide |
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 | | ZG6 | | Name: | N-(3-methyl-1,2-oxazol-5-yl)acetamide | | Formula: | C6 H8 N2 O2 | | SMILES: | O=C(C)Nc1cc(C)no1 | | InChi: | InChI=1S/C6H8N2O2/c1-4-3-6(10-8-4)7-5(2)9/h3H,1-2H3,(H,7,9) | | Definition date: | 2023-06-23 | | Last modified: | 2023-07-07 | | Release date: | 2023-07-12 | | Identifier: | N-(3-methyl-1,2-oxazol-5-yl)acetamide |
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 | | ZGI | | Name: | (1R,2S,5S)-N-{(2S)-1-(1,3-benzothiazol-2-yl)-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-3-[N-(tert-butylcarbamoyl)-3-methyl-L-valyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide | | Formula: | C33 H46 N6 O5 S | | SMILES: | CC(C)(C)NC(=O)NC(C(=O)N1CC2C(C1C(=O)NC(CC1CCNC1=O)C(=O)c1nc3ccccc3s1)C2(C)C)C(C)(C)C | | InChi: | InChI=1S/C33H46N6O5S/c1-31(2,3)25(37-30(44)38-32(4,5)6)29(43)39-16-18-22(33(18,7)8)23(39)27(42)35-20(15-17-13-14-34-26(17)41)24(40)28-36-19-11-9-10-12-21(19)45-28/h9-12,17-18,20,22-23,25H,13-16H2,1-8H3,(H,34,41)(H,35,42)(H2,37,38,44)/t17-,18-,20-,22-,23-,25+/m0/s1 | | Definition date: | 2023-03-09 | | Last modified: | 2023-07-07 | | Release date: | 2023-07-12 | | Identifier: | (1R,2S,5S)-N-{(2S)-1-(1,3-benzothiazol-2-yl)-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-3-[N-(tert-butylcarbamoyl)-3-methyl-L-valyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide |
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 | | ZGK | | Name: | N-(2-methoxyphenyl)acetamide | | Formula: | C9 H11 N O2 | | SMILES: | COc1ccccc1NC(C)=O | | InChi: | InChI=1S/C9H11NO2/c1-7(11)10-8-5-3-4-6-9(8)12-2/h3-6H,1-2H3,(H,10,11) | | Definition date: | 2023-06-23 | | Last modified: | 2023-07-07 | | Release date: | 2023-07-12 | | Identifier: | N-(2-methoxyphenyl)acetamide |
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