Vitas-M small molecule compound
ethyl 2-{(3E)-3-[hydroxy(4-methoxyphenyl)methylidene]-4,5-dioxo-2-phenylpyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK609204
SMILES CCOC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)OC)/O)/C1c1ccccc1
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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 C25H22N2O6S MW 478.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O6S/c1-4-33-24(31)22-14(2)26-25(34-22)27-19(15-8-6-5-7-9-15)18(21(29)23(27)30)20(28)16-10-12-17(32-3)13-11-16/h5-13,19,28H,4H2,1-3H3/b20-18+InChIKey
RXSQDQZUQVIWPA-CZIZESTLSA-NSynonyms
371134-83-7371134837
CCOC(=O)C1=C(N=C(S1)N2C(C(=C(C3=CC=C(C=C3)OC)O)C(=O)C2=O)C4=CC=CC=C4)C
CCOC(=O)c1sc(nc1C)N1C(=O)C(=O)C(=C(c2ccc(cc2)OC)O)C1c1ccccc1
ethyl2((3E)3(hydroxy(4methoxyphenyl)methylidene)45dioxo2phenylpyrrolidin1yl)4methyl13thiazole5carboxylate
ETHYL2((4E)4(HYDROXY(4METHOXYPHENYL)METHYLIDENE)23DIOXO5PHENYLPYRROLIDIN1YL)4METHYL13THIAZOLE5CARBOXYLATE
ETHYL2(3HYDROXY4((4METHOXYPHENYL)CARBONYL)2OXO5PHENYL(3PYRROLINYL))4METHYL13THIAZOLE5CARBOXYLATE
InChI=1SC25H22N2O6Sc143324(31)2214(2)2625(3422)2719(158657915)18(21(29)23(27)30)20(28)16101217(323)131116h5131928H4H213H3b2018+
MFCD08734504
ZINC000102705710
ZINC000102705715
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