| VNX | Name: | 5-cyclopropyl-2H-tetrazole | Formula: | C4 H6 N4 | SMILES: | C1CC1c1n[NH]nn1 | InChi: | InChI=1S/C4H6N4/c1-2-3(1)4-5-7-8-6-4/h3H,1-2H2,(H,5,6,7,8) | Definition date: | 2022-09-02 | Last modified: | 2022-10-28 | Release date: | 2022-11-02 | Identifier: | 5-cyclopropyl-2H-tetrazole |
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| UTE | Name: | 4-[2,4-bis(oxidanylidene)-6-(trifluoromethyl)-1H-pyrimidin-3-yl]-5-methyl-2-(2-methylphenoxy)benzenecarbonitrile | Formula: | C20 H14 F3 N3 O3 | SMILES: | Cc1ccccc1Oc2cc(N3C(=O)NC(=CC3=O)C(F)(F)F)c(C)cc2C#N | InChi: | InChI=1S/C20H14F3N3O3/c1-11-5-3-4-6-15(11)29-16-8-14(12(2)7-13(16)10-24)26-18(27)9-17(20(21,22)23)25-19(26)28/h3-9H,1-2H3,(H,25,28) | Synonyms: | 4-[2,4-bis(oxidanylidene)-6-(trifluoromethyl)-1~{H}-pyrimidin-3-yl]-5-methyl-2-(2-methylphenoxy)benzenecarbonitrile | Definition date: | 2021-03-17 | Last modified: | 2022-10-28 | Release date: | 2022-11-02 | Identifier: | 4-[2,4-bis(oxidanylidene)-6-(trifluoromethyl)-1~{H}-pyrimidin-3-yl]-5-methyl-2-(2-methylphenoxy)benzenecarbonitrile |
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| V8E | Name: | (4-butanoylpiperazin-1-yl)acetic acid | Formula: | C10 H18 N2 O3 | SMILES: | OC(=O)CN1CCN(CC1)C(=O)CCC | InChi: | InChI=1S/C10H18N2O3/c1-2-3-9(13)12-6-4-11(5-7-12)8-10(14)15/h2-8H2,1H3,(H,14,15) | Definition date: | 2022-08-29 | Last modified: | 2022-10-28 | Release date: | 2022-11-02 | Identifier: | (4-butanoylpiperazin-1-yl)acetic acid |
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| W36 | Name: | 2-amino-N-(3-fluoro-4-methylphenyl)ethane-1-sulfonamide | Formula: | C9 H13 F N2 O2 S | SMILES: | O=S(=O)(Nc1ccc(C)c(F)c1)CCN | InChi: | InChI=1S/C9H13FN2O2S/c1-7-2-3-8(6-9(7)10)12-15(13,14)5-4-11/h2-3,6,12H,4-5,11H2,1H3 | Definition date: | 2022-09-02 | Last modified: | 2022-10-28 | Release date: | 2022-11-02 | Identifier: | 2-amino-N-(3-fluoro-4-methylphenyl)ethane-1-sulfonamide |
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| V8L | Name: | N'-phenylacetohydrazide | Formula: | C8 H10 N2 O | SMILES: | CC(=O)NNc1ccccc1 | InChi: | InChI=1S/C8H10N2O/c1-7(11)9-10-8-5-3-2-4-6-8/h2-6,10H,1H3,(H,9,11) | Definition date: | 2022-08-29 | Last modified: | 2022-10-28 | Release date: | 2022-11-02 | Identifier: | N'-phenylacetohydrazide |
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| VO5 | Name: | N-ethyl-2-methoxybenzene-1-sulfonamide | Formula: | C9 H13 N O3 S | SMILES: | O=S(=O)(NCC)c1ccccc1OC | InChi: | InChI=1S/C9H13NO3S/c1-3-10-14(11,12)9-7-5-4-6-8(9)13-2/h4-7,10H,3H2,1-2H3 | Definition date: | 2022-09-02 | Last modified: | 2022-10-28 | Release date: | 2022-11-02 | Identifier: | N-ethyl-2-methoxybenzene-1-sulfonamide |
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| UTK | Name: | 4-[2,4-bis(oxidanylidene)-6-(trifluoromethyl)-1H-pyrimidin-3-yl]-5-fluoranyl-2-(2-methylphenoxy)benzenecarbonitrile | Formula: | C19 H11 F4 N3 O3 | SMILES: | Cc1ccccc1Oc2cc(N3C(=O)NC(=CC3=O)C(F)(F)F)c(F)cc2C#N | InChi: | InChI=1S/C19H11F4N3O3/c1-10-4-2-3-5-14(10)29-15-7-13(12(20)6-11(15)9-24)26-17(27)8-16(19(21,22)23)25-18(26)28/h2-8H,1H3,(H,25,28) | Synonyms: | 4-[2,4-bis(oxidanylidene)-6-(trifluoromethyl)-1~{H}-pyrimidin-3-yl]-5-fluoranyl-2-(2-methylphenoxy)benzenecarbonitrile | Definition date: | 2021-03-17 | Last modified: | 2022-10-28 | Release date: | 2022-11-02 | Identifier: | 4-[2,4-bis(oxidanylidene)-6-(trifluoromethyl)-1~{H}-pyrimidin-3-yl]-5-fluoranyl-2-(2-methylphenoxy)benzenecarbonitrile |
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| VO9 | Name: | N-cyclopropyl-N-(2-hydroxyethyl)thiophene-2-carboxamide | Formula: | C10 H13 N O2 S | SMILES: | O=C(N(CCO)C1CC1)c1cccs1 | InChi: | InChI=1S/C10H13NO2S/c12-6-5-11(8-3-4-8)10(13)9-2-1-7-14-9/h1-2,7-8,12H,3-6H2 | Definition date: | 2022-09-02 | Last modified: | 2022-10-28 | Release date: | 2022-11-02 | Identifier: | N-cyclopropyl-N-(2-hydroxyethyl)thiophene-2-carboxamide |
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| W3B | Name: | methyl N-[3-chloro-4-(difluoromethoxy)phenyl]glycinate | Formula: | C10 H10 Cl F2 N O3 | SMILES: | Clc1cc(ccc1OC(F)F)NCC(=O)OC | InChi: | InChI=1S/C10H10ClF2NO3/c1-16-9(15)5-14-6-2-3-8(7(11)4-6)17-10(12)13/h2-4,10,14H,5H2,1H3 | Definition date: | 2022-09-02 | Last modified: | 2022-10-28 | Release date: | 2022-11-02 | Identifier: | methyl N-[3-chloro-4-(difluoromethoxy)phenyl]glycinate |
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| UTN | Name: | 4-[2,4-bis(oxidanylidene)-6-(trifluoromethyl)-1H-pyrimidin-3-yl]-5-methoxy-2-(2-methylphenoxy)benzenecarbonitrile | Formula: | C20 H14 F3 N3 O4 | SMILES: | COc1cc(C#N)c(Oc2ccccc2C)cc1N3C(=O)NC(=CC3=O)C(F)(F)F | InChi: | InChI=1S/C20H14F3N3O4/c1-11-5-3-4-6-14(11)30-15-8-13(16(29-2)7-12(15)10-24)26-18(27)9-17(20(21,22)23)25-19(26)28/h3-9H,1-2H3,(H,25,28) | Synonyms: | 4-[2,4-bis(oxidanylidene)-6-(trifluoromethyl)-1~{H}-pyrimidin-3-yl]-5-methoxy-2-(2-methylphenoxy)benzenecarbonitrile | Definition date: | 2021-03-17 | Last modified: | 2022-10-28 | Release date: | 2022-11-02 | Identifier: | 4-[2,4-bis(oxidanylidene)-6-(trifluoromethyl)-1~{H}-pyrimidin-3-yl]-5-methoxy-2-(2-methylphenoxy)benzenecarbonitrile |
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| UTQ | Name: | 3-(5-chloranyl-2,4-dimethoxy-phenyl)-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione | Formula: | C13 H10 Cl F3 N2 O4 | SMILES: | COc1cc(OC)c(cc1Cl)N2C(=O)NC(=CC2=O)C(F)(F)F | InChi: | InChI=1S/C13H10ClF3N2O4/c1-22-8-4-9(23-2)7(3-6(8)14)19-11(20)5-10(13(15,16)17)18-12(19)21/h3-5H,1-2H3,(H,18,21) | Synonyms: | 3-(5-chloranyl-2,4-dimethoxy-phenyl)-6-(trifluoromethyl)-1~{H}-pyrimidine-2,4-dione | Definition date: | 2021-03-17 | Last modified: | 2022-10-28 | Release date: | 2022-11-02 | Identifier: | 3-(5-chloranyl-2,4-dimethoxy-phenyl)-6-(trifluoromethyl)-1~{H}-pyrimidine-2,4-dione |
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| VOE | Name: | (2R)-2-phenylbutan-1-amine | Formula: | C10 H15 N | SMILES: | NCC(CC)c1ccccc1 | InChi: | InChI=1S/C10H15N/c1-2-9(8-11)10-6-4-3-5-7-10/h3-7,9H,2,8,11H2,1H3/t9-/m0/s1 | Definition date: | 2022-09-02 | Last modified: | 2022-10-28 | Release date: | 2022-11-02 | Identifier: | (2R)-2-phenylbutan-1-amine |
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| V8T | Name: | (1R)-1-{4-[(propan-2-yl)oxy]phenyl}ethan-1-amine | Formula: | C11 H17 N O | SMILES: | CC(C)Oc1ccc(cc1)C(C)N | InChi: | InChI=1S/C11H17NO/c1-8(2)13-11-6-4-10(5-7-11)9(3)12/h4-9H,12H2,1-3H3/t9-/m1/s1 | Definition date: | 2022-08-29 | Last modified: | 2022-10-28 | Release date: | 2022-11-02 | Identifier: | (1R)-1-{4-[(propan-2-yl)oxy]phenyl}ethan-1-amine |
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| UTT | Name: | 2-[[4-chloranyl-2,6-bis(fluoranyl)phenyl]methylamino]-7-oxidanylidene-5-propyl-4H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile | Formula: | C17 H14 Cl F2 N5 O | SMILES: | CCCC1=CC(=O)n2nc(NCc3c(F)cc(Cl)cc3F)c(C#N)c2N1 | InChi: | InChI=1S/C17H14ClF2N5O/c1-2-3-10-6-15(26)25-17(23-10)11(7-21)16(24-25)22-8-12-13(19)4-9(18)5-14(12)20/h4-6,23H,2-3,8H2,1H3,(H,22,24) | Synonyms: | 2-[[4-chloranyl-2,6-bis(fluoranyl)phenyl]methylamino]-7-oxidanylidene-5-propyl-4~{H}-pyrazolo[1,5-a]pyrimidine-3-carbonitrile | Definition date: | 2021-03-17 | Last modified: | 2022-10-28 | Release date: | 2022-11-02 | Identifier: | 2-[[4-chloranyl-2,6-bis(fluoranyl)phenyl]methylamino]-7-oxidanylidene-5-propyl-4~{H}-pyrazolo[1,5-a]pyrimidine-3-carbonitrile |
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| W3H | Name: | (3R)-3-(4-chlorobenzene-1-sulfonyl)butanoic acid | Formula: | C10 H11 Cl O4 S | SMILES: | O=S(=O)(c1ccc(Cl)cc1)C(C)CC(=O)O | InChi: | InChI=1S/C10H11ClO4S/c1-7(6-10(12)13)16(14,15)9-4-2-8(11)3-5-9/h2-5,7H,6H2,1H3,(H,12,13)/t7-/m1/s1 | Definition date: | 2022-09-02 | Last modified: | 2022-10-28 | Release date: | 2022-11-02 | Identifier: | (3R)-3-(4-chlorobenzene-1-sulfonyl)butanoic acid |
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| VOK | Name: | 5,5-diethyl-1-methyl-1,3-diazinane-2,4,6-trione | Formula: | C9 H14 N2 O3 | SMILES: | O=C1NC(=O)N(C)C(=O)C1(CC)CC | InChi: | InChI=1S/C9H14N2O3/c1-4-9(5-2)6(12)10-8(14)11(3)7(9)13/h4-5H2,1-3H3,(H,10,12,14) | Definition date: | 2022-09-02 | Last modified: | 2022-10-28 | Release date: | 2022-11-02 | Identifier: | 5,5-diethyl-1-methyl-1,3-diazinane-2,4,6-trione |
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| V92 | Name: | 4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carbonitrile | Formula: | C10 H6 N2 O2 | SMILES: | OC=1c2ccccc2NC(=O)C=1C#N | InChi: | InChI=1S/C10H6N2O2/c11-5-7-9(13)6-3-1-2-4-8(6)12-10(7)14/h1-4H,(H2,12,13,14) | Definition date: | 2022-08-29 | Last modified: | 2022-10-28 | Release date: | 2022-11-02 | Identifier: | 4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carbonitrile |
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| UU2 | Name: | 4-[6-[bis(fluoranyl)-phenyl-methyl]-2,4-bis(oxidanylidene)-1~{H}-pyrimidin-3-yl]-5-fluoranyl-2-(2-methylphenoxy)benzenecarbonitrile | Formula: | C25 H16 F3 N3 O3 | SMILES: | Cc1ccccc1Oc2cc(N3C(=O)NC(=CC3=O)C(F)(F)c4ccccc4)c(F)cc2C#N | InChi: | InChI=1S/C25H16F3N3O3/c1-15-7-5-6-10-20(15)34-21-12-19(18(26)11-16(21)14-29)31-23(32)13-22(30-24(31)33)25(27,28)17-8-3-2-4-9-17/h2-13H,1H3,(H,30,33) | Synonyms: | 4-[6-[bis(fluoranyl)-phenyl-methyl]-2,4-bis(oxidanylidene)-1H-pyrimidin-3-yl]-5-fluoranyl-2-(2-methylphenoxy)benzenecarbonitrile | Definition date: | 2021-03-19 | Last modified: | 2022-10-28 | Release date: | 2022-11-02 | Identifier: | 4-[6-[bis(fluoranyl)-phenyl-methyl]-2,4-bis(oxidanylidene)-1~{H}-pyrimidin-3-yl]-5-fluoranyl-2-(2-methylphenoxy)benzenecarbonitrile |
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| W3Q | Name: | N-[(2-methoxyphenyl)methyl]urea | Formula: | C9 H12 N2 O2 | SMILES: | COc1ccccc1CNC(N)=O | InChi: | InChI=1S/C9H12N2O2/c1-13-8-5-3-2-4-7(8)6-11-9(10)12/h2-5H,6H2,1H3,(H3,10,11,12) | Definition date: | 2022-09-02 | Last modified: | 2022-10-28 | Release date: | 2022-11-02 | Identifier: | N-[(2-methoxyphenyl)methyl]urea |
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| W3U | Name: | 1-benzyl-1H-pyrazole-4-carboxylic acid | Formula: | C11 H10 N2 O2 | SMILES: | O=C(O)c1cn(Cc2ccccc2)nc1 | InChi: | InChI=1S/C11H10N2O2/c14-11(15)10-6-12-13(8-10)7-9-4-2-1-3-5-9/h1-6,8H,7H2,(H,14,15) | Definition date: | 2022-09-02 | Last modified: | 2022-10-28 | Release date: | 2022-11-02 | Identifier: | 1-benzyl-1H-pyrazole-4-carboxylic acid |
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| V99 | Name: | 3-ethyl-5-(ethylsulfanyl)-4H-1,2,4-triazol-4-amine | Formula: | C6 H12 N4 S | SMILES: | CCSc1nnc(CC)n1N | InChi: | InChI=1S/C6H12N4S/c1-3-5-8-9-6(10(5)7)11-4-2/h3-4,7H2,1-2H3 | Definition date: | 2022-08-29 | Last modified: | 2022-10-28 | Release date: | 2022-11-02 | Identifier: | 3-ethyl-5-(ethylsulfanyl)-4H-1,2,4-triazol-4-amine |
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| VOQ | Name: | N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,2-dimethyl-L-alaninamide | Formula: | C11 H19 N3 O2 | SMILES: | CN(Cc1c(C)onc1C)C(=O)C(C)(C)N | InChi: | InChI=1S/C11H19N3O2/c1-7-9(8(2)16-13-7)6-14(5)10(15)11(3,4)12/h6,12H2,1-5H3 | Definition date: | 2022-09-02 | Last modified: | 2022-10-28 | Release date: | 2022-11-02 | Identifier: | N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,2-dimethyl-L-alaninamide |
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| UU8 | Name: | 4-[2,4-bis(oxidanylidene)-6-(phenylsulfonyl)-1H-pyrimidin-3-yl]-5-fluoranyl-2-(2-methylphenoxy)benzenecarbonitrile | Formula: | C24 H16 F N3 O5 S | SMILES: | Cc1ccccc1Oc2cc(N3C(=O)NC(=CC3=O)[S](=O)(=O)c4ccccc4)c(F)cc2C#N | InChi: | InChI=1S/C24H16FN3O5S/c1-15-7-5-6-10-20(15)33-21-12-19(18(25)11-16(21)14-26)28-23(29)13-22(27-24(28)30)34(31,32)17-8-3-2-4-9-17/h2-13H,1H3,(H,27,30) | Synonyms: | 4-[2,4-bis(oxidanylidene)-6-(phenylsulfonyl)-1~{H}-pyrimidin-3-yl]-5-fluoranyl-2-(2-methylphenoxy)benzenecarbonitrile | Definition date: | 2021-03-19 | Last modified: | 2022-10-28 | Release date: | 2022-11-02 | Identifier: | 4-[2,4-bis(oxidanylidene)-6-(phenylsulfonyl)-1~{H}-pyrimidin-3-yl]-5-fluoranyl-2-(2-methylphenoxy)benzenecarbonitrile |
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| W3Z | Name: | ethyl (3S)-1-(methanesulfonyl)piperidine-3-carboxylate | Formula: | C9 H17 N O4 S | SMILES: | O=S(C)(=O)N1CCCC(C1)C(=O)OCC | InChi: | InChI=1S/C9H17NO4S/c1-3-14-9(11)8-5-4-6-10(7-8)15(2,12)13/h8H,3-7H2,1-2H3/t8-/m0/s1 | Definition date: | 2022-09-02 | Last modified: | 2022-10-28 | Release date: | 2022-11-02 | Identifier: | ethyl (3S)-1-(methanesulfonyl)piperidine-3-carboxylate |
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| VOW | Name: | (4-ethoxyphenyl)-oxidanyl-oxidanylidene-boron | Formula: | C8 H11 B O3 | SMILES: | CCOc1ccc(cc1)B(O)O | InChi: | InChI=1S/C8H11BO3/c1-2-12-8-5-3-7(4-6-8)9(10)11/h3-6,10-11H,2H2,1H3 | Definition date: | 2022-09-02 | Last modified: | 2022-10-28 | Release date: | 2022-11-02 | Identifier: | (4-ethoxyphenyl)boronic acid |
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