 | | VD6 | | Name: | (2R)-1-benzylpiperidine-2-carboxylic acid | | Formula: | C13 H17 N O2 | | SMILES: | O=C(O)C1CCCCN1Cc1ccccc1 | | InChi: | InChI=1S/C13H17NO2/c15-13(16)12-8-4-5-9-14(12)10-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2,(H,15,16)/t12-/m1/s1 | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | (2R)-1-benzylpiperidine-2-carboxylic acid |
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 | | VRY | | Name: | 1-[(2-chloro-4-methoxyphenyl)methyl]-1H-1,2,4-triazole | | Formula: | C10 H10 Cl N3 O | | SMILES: | COc1cc(Cl)c(Cn2cncn2)cc1 | | InChi: | InChI=1S/C10H10ClN3O/c1-15-9-3-2-8(10(11)4-9)5-14-7-12-6-13-14/h2-4,6-7H,5H2,1H3 | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 1-[(2-chloro-4-methoxyphenyl)methyl]-1H-1,2,4-triazole |
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 | | VDD | | Name: | (2S)-2-[(pyridin-2-yl)sulfanyl]propanoic acid | | Formula: | C8 H9 N O2 S | | SMILES: | CC(Sc1ccccn1)C(=O)O | | InChi: | InChI=1S/C8H9NO2S/c1-6(8(10)11)12-7-4-2-3-5-9-7/h2-6H,1H3,(H,10,11)/t6-/m0/s1 | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | (2S)-2-[(pyridin-2-yl)sulfanyl]propanoic acid |
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 | | UXB | | Name: | (3S)-3-amino-3-(3-chlorophenyl)propan-1-ol | | Formula: | C9 H12 Cl N O | | SMILES: | NC(CCO)c1cc(Cl)ccc1 | | InChi: | InChI=1S/C9H12ClNO/c10-8-3-1-2-7(6-8)9(11)4-5-12/h1-3,6,9,12H,4-5,11H2/t9-/m0/s1 | | Definition date: | 2022-08-26 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | (3S)-3-amino-3-(3-chlorophenyl)propan-1-ol |
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 | | VDI | | Name: | 1-(4-chlorophenyl)cyclobutane-1-carboxylic acid | | Formula: | C11 H11 Cl O2 | | SMILES: | OC(=O)C1(CCC1)c1ccc(Cl)cc1 | | InChi: | InChI=1S/C11H11ClO2/c12-9-4-2-8(3-5-9)11(10(13)14)6-1-7-11/h2-5H,1,6-7H2,(H,13,14) | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 1-(4-chlorophenyl)cyclobutane-1-carboxylic acid |
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 | | W8B | | Name: | 4-chloro-5-(morpholin-4-yl)pyridazin-3(2H)-one | | Formula: | C8 H10 Cl N3 O2 | | SMILES: | ClC1=C(C=NNC1=O)N1CCOCC1 | | InChi: | InChI=1S/C8H10ClN3O2/c9-7-6(5-10-11-8(7)13)12-1-3-14-4-2-12/h5H,1-4H2,(H,11,13) | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 4-chloro-5-(morpholin-4-yl)pyridazin-3(2H)-one |
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 | | VS7 | | Name: | (2R)-1-(1H-indol-3-yl)propan-2-amine | | Formula: | C11 H14 N2 | | SMILES: | CC(N)Cc1c[NH]c2ccccc21 | | InChi: | InChI=1S/C11H14N2/c1-8(12)6-9-7-13-11-5-3-2-4-10(9)11/h2-5,7-8,13H,6,12H2,1H3/t8-/m1/s1 | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | (2R)-1-(1H-indol-3-yl)propan-2-amine |
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 | | W8F | | Name: | 1-(3-methoxy-4-methylphenyl)methanamine | | Formula: | C9 H13 N O | | SMILES: | Cc1ccc(cc1OC)CN | | InChi: | InChI=1S/C9H13NO/c1-7-3-4-8(6-10)5-9(7)11-2/h3-5H,6,10H2,1-2H3 | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 1-(3-methoxy-4-methylphenyl)methanamine |
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 | | W8K | | Name: | N-[(3-bromophenyl)methyl]acetamide | | Formula: | C9 H10 Br N O | | SMILES: | Brc1cc(CNC(C)=O)ccc1 | | InChi: | InChI=1S/C9H10BrNO/c1-7(12)11-6-8-3-2-4-9(10)5-8/h2-5H,6H2,1H3,(H,11,12) | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | N-[(3-bromophenyl)methyl]acetamide |
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 | | VSL | | Name: | methyl 4,5,6,7-tetrahydro-2H-indazole-3-carboxylate | | Formula: | C9 H12 N2 O2 | | SMILES: | O=C(OC)c1[NH]nc2CCCCc12 | | InChi: | InChI=1S/C9H12N2O2/c1-13-9(12)8-6-4-2-3-5-7(6)10-11-8/h2-5H2,1H3,(H,10,11) | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | methyl 4,5,6,7-tetrahydro-2H-indazole-3-carboxylate |
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 | | VE0 | | Name: | N-hydroxy-2-(piperidin-1-yl)pyridine-3-carboximidamide | | Formula: | C11 H16 N4 O | | SMILES: | N=C(NO)c1cccnc1N1CCCCC1 | | InChi: | InChI=1S/C11H16N4O/c12-10(14-16)9-5-4-6-13-11(9)15-7-2-1-3-8-15/h4-6,16H,1-3,7-8H2,(H2,12,14) | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | N-hydroxy-2-(piperidin-1-yl)pyridine-3-carboximidamide |
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 | | VE3 | | Name: | N,N,4-triethyl-1,2,3-thiadiazole-5-carboxamide | | Formula: | C9 H15 N3 O S | | SMILES: | O=C(c1snnc1CC)N(CC)CC | | InChi: | InChI=1S/C9H15N3OS/c1-4-7-8(14-11-10-7)9(13)12(5-2)6-3/h4-6H2,1-3H3 | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | N,N,4-triethyl-1,2,3-thiadiazole-5-carboxamide |
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 | | VSQ | | Name: | N~2~-phenylglycinamide | | Formula: | C8 H10 N2 O | | SMILES: | NC(=O)CNc1ccccc1 | | InChi: | InChI=1S/C8H10N2O/c9-8(11)6-10-7-4-2-1-3-5-7/h1-5,10H,6H2,(H2,9,11) | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | N~2~-phenylglycinamide |
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 | | W8W | | Name: | 5-bromo-1-methylpyrimidine-2,4(1H,3H)-dione | | Formula: | C5 H5 Br N2 O2 | | SMILES: | O=C1NC(=O)N(C)C=C1Br | | InChi: | InChI=1S/C5H5BrN2O2/c1-8-2-3(6)4(9)7-5(8)10/h2H,1H3,(H,7,9,10) | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 5-bromo-1-methylpyrimidine-2,4(1H,3H)-dione |
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 | | VST | | Name: | (4Z)-6-fluoro-4-(methoxyimino)-3,4-dihydro-1-benzothiopyran-1,1(2H)-dione | | Formula: | C10 H10 F N O3 S | | SMILES: | Fc1ccc2c(c1)C(/CCS2(=O)=O)=NOC | | InChi: | InChI=1S/C10H10FNO3S/c1-15-12-9-4-5-16(13,14)10-3-2-7(11)6-8(9)10/h2-3,6H,4-5H2,1H3/b12-9- | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | (4Z)-6-fluoro-4-(methoxyimino)-3,4-dihydro-1-benzothiopyran-1,1(2H)-dione |
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 | | VSX | | Name: | N-(2-amino-5-chlorophenyl)acetamide | | Formula: | C8 H9 Cl N2 O | | SMILES: | Nc1ccc(Cl)cc1NC(C)=O | | InChi: | InChI=1S/C8H9ClN2O/c1-5(12)11-8-4-6(9)2-3-7(8)10/h2-4H,10H2,1H3,(H,11,12) | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | N-(2-amino-5-chlorophenyl)acetamide |
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 | | W93 | | Name: | (2R)-2-amino-2-(3-methoxyphenyl)ethan-1-ol | | Formula: | C9 H13 N O2 | | SMILES: | COc1cc(ccc1)C(N)CO | | InChi: | InChI=1S/C9H13NO2/c1-12-8-4-2-3-7(5-8)9(10)6-11/h2-5,9,11H,6,10H2,1H3/t9-/m0/s1 | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | (2R)-2-amino-2-(3-methoxyphenyl)ethan-1-ol |
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 | | VEC | | Name: | methyl N-(3-hydroxybenzoyl)-N-methylglycinate | | Formula: | C11 H13 N O4 | | SMILES: | O=C(c1cc(O)ccc1)N(C)CC(=O)OC | | InChi: | InChI=1S/C11H13NO4/c1-12(7-10(14)16-2)11(15)8-4-3-5-9(13)6-8/h3-6,13H,7H2,1-2H3 | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | methyl N-(3-hydroxybenzoyl)-N-methylglycinate |
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 | | W98 | | Name: | N-cyclopropyl-N-[(thiophen-2-yl)methyl]methanesulfonamide | | Formula: | C9 H13 N O2 S2 | | SMILES: | O=S(C)(=O)N(Cc1cccs1)C1CC1 | | InChi: | InChI=1S/C9H13NO2S2/c1-14(11,12)10(8-4-5-8)7-9-3-2-6-13-9/h2-3,6,8H,4-5,7H2,1H3 | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | N-cyclopropyl-N-[(thiophen-2-yl)methyl]methanesulfonamide |
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 | | UYL | | Name: | (5R)-2,7-diazaspiro[4.5]dec-1-en-3-one | | Formula: | C8 H12 N2 O | | SMILES: | O=C1N=CC2(C1)CCCNC2 | | InChi: | InChI=1S/C8H12N2O/c11-7-4-8(6-10-7)2-1-3-9-5-8/h6,9H,1-5H2/t8-/m1/s1 | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | (5R)-2,7-diazaspiro[4.5]dec-1-en-3-one |
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 | | VEL | | Name: | [4-(difluoromethoxy)phenyl]methanol | | Formula: | C8 H8 F2 O2 | | SMILES: | FC(F)Oc1ccc(cc1)CO | | InChi: | InChI=1S/C8H8F2O2/c9-8(10)12-7-3-1-6(5-11)2-4-7/h1-4,8,11H,5H2 | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | [4-(difluoromethoxy)phenyl]methanol |
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 | | VTC | | Name: | 3-aminophenyl dimethylcarbamate | | Formula: | C9 H12 N2 O2 | | SMILES: | O=C(Oc1cccc(N)c1)N(C)C | | InChi: | InChI=1S/C9H12N2O2/c1-11(2)9(12)13-8-5-3-4-7(10)6-8/h3-6H,10H2,1-2H3 | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 3-aminophenyl dimethylcarbamate |
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 | | W9E | | Name: | N-hydroxy-4-(trifluoromethyl)benzene-1-carboximidamide | | Formula: | C8 H7 F3 N2 O | | SMILES: | FC(F)(F)c1ccc(cc1)C(=N)NO | | InChi: | InChI=1S/C8H7F3N2O/c9-8(10,11)6-3-1-5(2-4-6)7(12)13-14/h1-4,14H,(H2,12,13) | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | N-hydroxy-4-(trifluoromethyl)benzene-1-carboximidamide |
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 | | UYR | | Name: | (2E)-2-cyano-3-(thiophen-3-yl)prop-2-enamide | | Formula: | C8 H6 N2 O S | | SMILES: | O=C(N)C(=C/c1ccsc1)/C#N | | InChi: | InChI=1S/C8H6N2OS/c9-4-7(8(10)11)3-6-1-2-12-5-6/h1-3,5H,(H2,10,11)/b7-3+ | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | (2E)-2-cyano-3-(thiophen-3-yl)prop-2-enamide |
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 | | W9I | | Name: | 5-bromo-2-hydrazinylpyridine | | Formula: | C5 H6 Br N3 | | SMILES: | Brc1cnc(NN)cc1 | | InChi: | InChI=1S/C5H6BrN3/c6-4-1-2-5(9-7)8-3-4/h1-3H,7H2,(H,8,9) | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 5-bromo-2-hydrazinylpyridine |
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