Vitas-M small molecule compound
ethyl 2-{(3E)-2-(4-hydroxyphenyl)-3-[hydroxy(phenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STL150776
SMILES CCOC(=O)c1sc(nc1C)N1C(c2ccc(cc2)O)/C(=C(/c2ccccc2)\O)/C(=O)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 C24H20N2O6S MW 464.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N2O6S/c1-3-32-23(31)21-13(2)25-24(33-21)26-18(14-9-11-16(27)12-10-14)17(20(29)22(26)30)19(28)15-7-5-4-6-8-15/h4-12,18,27-28H,3H2,1-2H3/b19-17+InChIKey
KOENGOYYNOXSPD-HTXNQAPBSA-NSynonyms
CCOC(=O)C1=C(N=C(S1)N2C(C(=C(C3=CC=CC=C3)O)C(=O)C2=O)C4=CC=C(C=C4)O)C
CCOC(=O)c1sc(nc1C)N1C(c2ccc(cc2)O)C(=C(c2ccccc2)O)C(=O)C1=O
ethyl2((3E)2(4hydroxyphenyl)3(hydroxy(phenyl)methylidene)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
InChI=1SC24H20N2O6Sc133223(31)2113(2)2524(3321)2618(1491116(27)121014)17(20(29)22(26)30)19(28)157546815h412182728H3H212H3b1917+
MFCD03794333
ZINC000102931891
ZINC000102931895
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