 | | 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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 | | 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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 | | 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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 | | 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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 | | 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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 | | 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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 | | 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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 | | 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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 | | 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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 | | VEX | | Name: | (2,3,4-trimethoxyphenyl)methanol | | Formula: | C10 H14 O4 | | SMILES: | COc1c(OC)c(ccc1OC)CO | | InChi: | InChI=1S/C10H14O4/c1-12-8-5-4-7(6-11)9(13-2)10(8)14-3/h4-5,11H,6H2,1-3H3 | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | (2,3,4-trimethoxyphenyl)methanol |
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 | | VF3 | | Name: | 4-(thiophene-2-sulfonyl)morpholine | | Formula: | C8 H11 N O3 S2 | | SMILES: | O=S(=O)(N1CCOCC1)c1cccs1 | | InChi: | InChI=1S/C8H11NO3S2/c10-14(11,8-2-1-7-13-8)9-3-5-12-6-4-9/h1-2,7H,3-6H2 | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 4-(thiophene-2-sulfonyl)morpholine |
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 | | VF9 | | Name: | 1-[(2S)-2-(furan-2-yl)azepan-1-yl]ethan-1-one | | Formula: | C12 H17 N O2 | | SMILES: | CC(=O)N1CCCCCC1c1ccco1 | | InChi: | InChI=1S/C12H17NO2/c1-10(14)13-8-4-2-3-6-11(13)12-7-5-9-15-12/h5,7,9,11H,2-4,6,8H2,1H3/t11-/m0/s1 | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 1-[(2S)-2-(furan-2-yl)azepan-1-yl]ethan-1-one |
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 | | WOR | | Name: | N'-(2-hydroxy-5-methylphenyl)-N-methyl-N-(propan-2-yl)sulfuric diamide | | Formula: | C11 H18 N2 O3 S | | SMILES: | Oc1ccc(C)cc1NS(=O)(=O)N(C)C(C)C | | InChi: | InChI=1S/C11H18N2O3S/c1-8(2)13(4)17(15,16)12-10-7-9(3)5-6-11(10)14/h5-8,12,14H,1-4H3 | | Definition date: | 2022-10-06 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | N'-(2-hydroxy-5-methylphenyl)-N-methyl-N-(propan-2-yl)sulfuric diamide |
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 | | VTW | | Name: | 3-phenyl-1,2-oxazole-5-carboxylic acid | | Formula: | C10 H7 N O3 | | SMILES: | O=C(O)c1cc(no1)c1ccccc1 | | InChi: | InChI=1S/C10H7NO3/c12-10(13)9-6-8(11-14-9)7-4-2-1-3-5-7/h1-6H,(H,12,13) | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 3-phenyl-1,2-oxazole-5-carboxylic acid |
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 | | T0U | | Name: | 4,4'-methylenediphenol | | Formula: | C13 H12 O2 | | SMILES: | Oc1ccc(Cc2ccc(O)cc2)cc1 | | InChi: | InChI=1S/C13H12O2/c14-12-5-1-10(2-6-12)9-11-3-7-13(15)8-4-11/h1-8,14-15H,9H2 | | Synonyms: | Bisphenol F | | Definition date: | 2022-07-14 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 4,4'-methylenediphenol |
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 | | VFL | | Name: | (2R)-1-amino-3-(2,4-dimethylphenoxy)propan-2-ol | | Formula: | C11 H17 N O2 | | SMILES: | NCC(O)COc1ccc(C)cc1C | | InChi: | InChI=1S/C11H17NO2/c1-8-3-4-11(9(2)5-8)14-7-10(13)6-12/h3-5,10,13H,6-7,12H2,1-2H3/t10-/m1/s1 | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | (2R)-1-amino-3-(2,4-dimethylphenoxy)propan-2-ol |
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 | | VU5 | | Name: | 1-[(2S)-2-hydroxy-3-(methylamino)propyl]pyrrolidin-2-one | | Formula: | C8 H16 N2 O2 | | SMILES: | O=C1CCCN1CC(O)CNC | | InChi: | InChI=1S/C8H16N2O2/c1-9-5-7(11)6-10-4-2-3-8(10)12/h7,9,11H,2-6H2,1H3/t7-/m0/s1 | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 1-[(2S)-2-hydroxy-3-(methylamino)propyl]pyrrolidin-2-one |
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 | | VU9 | | Name: | 1-phenylpiperazine | | Formula: | C10 H14 N2 | | SMILES: | c1cc(ccc1)N1CCNCC1 | | InChi: | InChI=1S/C10H14N2/c1-2-4-10(5-3-1)12-8-6-11-7-9-12/h1-5,11H,6-9H2 | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 1-phenylpiperazine |
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 | | VFR | | Name: | (3E)-N-benzyl-3-(hydroxyamino)-3-iminopropanamide | | Formula: | C10 H13 N3 O2 | | SMILES: | N=C(NO)CC(=O)NCc1ccccc1 | | InChi: | InChI=1S/C10H13N3O2/c11-9(13-15)6-10(14)12-7-8-4-2-1-3-5-8/h1-5,15H,6-7H2,(H2,11,13)(H,12,14) | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | (3E)-N-benzyl-3-(hydroxyamino)-3-iminopropanamide |
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 | | VUE | | Name: | 2-(4-chloro-2-nitroanilino)ethan-1-ol | | Formula: | C8 H9 Cl N2 O3 | | SMILES: | Clc1cc(c(NCCO)cc1)N(=O)=O | | InChi: | InChI=1S/C8H9ClN2O3/c9-6-1-2-7(10-3-4-12)8(5-6)11(13)14/h1-2,5,10,12H,3-4H2 | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 2-(4-chloro-2-nitroanilino)ethan-1-ol |
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 | | VUI | | Name: | 4-bromo-1-(2-methoxyethoxy)-2-nitrobenzene | | Formula: | C9 H10 Br N O4 | | SMILES: | Brc1cc(c(OCCOC)cc1)N(=O)=O | | InChi: | InChI=1S/C9H10BrNO4/c1-14-4-5-15-9-3-2-7(10)6-8(9)11(12)13/h2-3,6H,4-5H2,1H3 | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 4-bromo-1-(2-methoxyethoxy)-2-nitrobenzene |
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 | | VUN | | Name: | 4-{[(propan-2-yl)oxy]methyl}benzoic acid | | Formula: | C11 H14 O3 | | SMILES: | O=C(O)c1ccc(COC(C)C)cc1 | | InChi: | InChI=1S/C11H14O3/c1-8(2)14-7-9-3-5-10(6-4-9)11(12)13/h3-6,8H,7H2,1-2H3,(H,12,13) | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 4-{[(propan-2-yl)oxy]methyl}benzoic acid |
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 | | S7X | | Name: | 1-{2-[(2S)-2-{[(3-chloro-2-fluorophenyl)methyl]carbamoyl}pyrrolidin-1-yl]-2-oxoethyl}-1H-indazole-3-carboxamide | | Formula: | C22 H21 Cl F N5 O3 | | SMILES: | Clc1cccc(CNC(=O)C2CCCN2C(=O)Cn2nc(c3ccccc32)C(N)=O)c1F | | InChi: | InChI=1S/C22H21ClFN5O3/c23-15-7-3-5-13(19(15)24)11-26-22(32)17-9-4-10-28(17)18(30)12-29-16-8-2-1-6-14(16)20(27-29)21(25)31/h1-3,5-8,17H,4,9-12H2,(H2,25,31)(H,26,32)/t17-/m0/s1 | | Definition date: | 2022-06-24 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 1-{2-[(2S)-2-{[(3-chloro-2-fluorophenyl)methyl]carbamoyl}pyrrolidin-1-yl]-2-oxoethyl}-1H-indazole-3-carboxamide |
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