Vitas-M small molecule compound
(2E)-4-{[4-(3,4-dimethylphenyl)-3-(methoxycarbonyl)-5-methylthiophen-2-yl]amino}-4-oxobut-2-enoic acid
Catalog ID
STK315947
SMILES COC(=O)c1c(NC(=O)/C=C/C(=O)O)sc(c1c1ccc(c(c1)C)C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C19H19NO5S MW 373.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19NO5S/c1-10-5-6-13(9-11(10)2)16-12(3)26-18(17(16)19(24)25-4)20-14(21)7-8-15(22)23/h5-9H,1-4H3,(H,20,21)(H,22,23)/b8-7+InChIKey
DARDLSOHWBBFCG-BQYQJAHWSA-NSynonyms
1164466-07-2(2E)4((4(34dimethylphenyl)3(methoxycarbonyl)5methylthiophen2yl)amino)4oxobut2enoicacid
(E)4((3CARBOMETHOXY4(34DIMETHYLPHENYL)5METHYL2THIENYL)AMINO)4KETOBUT2ENOICACID
(E)4((4(34DIMETHYLPHENYL)3METHOXYCARBONYL5METHYL2THIOPHENYL)AMINO)4OXO2BUTENOICACID
(E)4((4(34DIMETHYLPHENYL)3METHOXYCARBONYL5METHYLTHIOPHEN2YL)AMINO)4OXIDANYLIDENEBUT2ENOICACID
(E)4((4(34DIMETHYLPHENYL)3METHOXYCARBONYL5METHYLTHIOPHEN2YL)AMINO)4OXOBUT2ENOICACID
1164466072
4((4(34DIMETHYLPHENYL)3(METHOXYCARBONYL)5METHYL2THIENYL)AMINO)4OXO2BUTENOICACID
CC1=C(C=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)C=CC(=O)O)C)C
COC(=O)c1c(NC(=O)C=CC(=O)O)sc(c1c1ccc(c(c1)C)C)C
InChI=1SC19H19NO5Sc1105613(911(10)2)1612(3)2618(17(16)19(24)254)2014(21)7815(22)23h59H14H3(H2021)(H2223)b87+
MFCD02175933
ZINC000002758362
ZINC2758362
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