Vitas-M small molecule compound
ethyl 2-[(3E)-3-[hydroxy(4-propoxyphenyl)methylidene]-2-(4-methylphenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK564030
SMILES CCCOc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)C)N(C(=O)C1=O)c1sc(c(n1)C)C(=O)OCC)/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 C28H28N2O6S MW 520.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O6S/c1-5-15-36-20-13-11-19(12-14-20)23(31)21-22(18-9-7-16(3)8-10-18)30(26(33)24(21)32)28-29-17(4)25(37-28)27(34)35-6-2/h7-14,22,31H,5-6,15H2,1-4H3/b23-21+InChIKey
CXDVXSKRRBYEFF-XTQSDGFTSA-NSynonyms
614747-92-1CCCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NC(=C(S3)C(=O)OCC)C)C4=CC=C(C=C4)C)O
CCCOc1ccc(cc1)C(=C1C(c2ccc(cc2)C)N(C(=O)C1=O)c1sc(c(n1)C)C(=O)OCC)O
ethyl2((3E)3(hydroxy(4propoxyphenyl)methylidene)2(4methylphenyl)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
ETHYL2(3HYDROXY5(4METHYLPHENYL)2OXO4((4PROPOXYPHENYL)CARBONYL)(3PYRROLINYL))4METHYL13THIAZOLE5CARBOXYLATE
Registry IDs
MFCD03805613ZINC000102525279
ZINC000102525284
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