Vitas-M small molecule compound
ethyl (5E)-5-(2,3-dimethoxybenzylidene)-2-[(4-methoxyphenyl)amino]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STK158413
SMILES CCOC(=O)C1=C(Nc2ccc(cc2)OC)S/C(=C/c2cccc(c2OC)OC)/C1=O
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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 C23H23NO6S MW 441.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23NO6S/c1-5-30-23(26)19-20(25)18(13-14-7-6-8-17(28-3)21(14)29-4)31-22(19)24-15-9-11-16(27-2)12-10-15/h6-13,24H,5H2,1-4H3/b18-13+InChIKey
SIRSXDFKWXTFSZ-QGOAFFKASA-NSynonyms
CCOC(=O)C1=C(Nc2ccc(cc2)OC)SC(=Cc2cccc(c2OC)OC)C1=O
CCOC(=O)C1=C(SC(=CC2=C(C(=CC=C2)OC)OC)C1=O)NC3=CC=C(C=C3)OC
ETHYL(5E)5((23DIMETHOXYPHENYL)METHYLIDENE)2(4METHOXYANILINO)4OXOTHIOPHENE3CARBOXYLATE
ETHYL(5E)5(23DIMETHOXYBENZYLIDENE)2((4METHOXYPHENYL)AMINO)4OXO45DIHYDROTHIOPHENE3CARBOXYLATE
InChI=1SC23H23NO6Sc153023(26)1920(25)18(131476817(283)21(14)294)3122(19)241591116(272)121015h61324H5H214H3b1813+
MFCD08679386
ZINC000001177223
ZINC01177223
ZINC1177223
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