Vitas-M small molecule compound
methyl 2-{(3E)-2-(2,4-dimethoxyphenyl)-3-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK563108
SMILES COc1ccc(c(c1)OC)C1/C(=C(/c2ccc(c(c2)C)OC)\O)/C(=O)C(=O)N1c1sc(c(n1)C)C(=O)OC
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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 C27H26N2O8S MW 538.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O8S/c1-13-11-15(7-10-18(13)35-4)22(30)20-21(17-9-8-16(34-3)12-19(17)36-5)29(25(32)23(20)31)27-28-14(2)24(38-27)26(33)37-6/h7-12,21,30H,1-6H3/b22-20+InChIKey
BYJQCSTXCUSRFM-LSDHQDQOSA-NSynonyms
488861-08-1488861081
CC1=C(C=CC(=C1)C(=C2C(N(C(=O)C2=O)C3=NC(=C(S3)C(=O)OC)C)C4=C(C=C(C=C4)OC)OC)O)OC
COc1ccc(c(c1)OC)C1C(=C(c2ccc(c(c2)C)OC)O)C(=O)C(=O)N1c1sc(c(n1)C)C(=O)OC
InChI=1SC27H26N2O8Sc1131115(71018(13)354)22(30)2021(179816(343)1219(17)365)29(25(32)23(20)31)272814(2)24(3827)26(33)376h7122130H16H3b2220+
methyl2((3E)2(24dimethoxyphenyl)3(hydroxy(4methoxy3methylphenyl)methylidene)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
METHYL2(5(24DIMETHOXYPHENYL)3HYDROXY4((4METHOXY3METHYLPHENYL)CARBONYL)2OXO(3PYRROLINYL))4METHYL13THIAZOLE5CARBOXYLATE
MFCD03812367
ZINC000102517887
ZINC000102517895
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