Vitas-M small molecule compound
ethyl 2-[(3E)-3-[hydroxy(4-methylphenyl)methylidene]-2-(4-methoxyphenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK847061
SMILES CCOC(=O)c1sc(nc1C)N1C(c2ccc(cc2)OC)/C(=C(/c2ccc(cc2)C)\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 C26H24N2O6S MW 492.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O6S/c1-5-34-25(32)23-15(3)27-26(35-23)28-20(16-10-12-18(33-4)13-11-16)19(22(30)24(28)31)21(29)17-8-6-14(2)7-9-17/h6-13,20,29H,5H2,1-4H3/b21-19+InChIKey
XRHGYXJMTPCNQW-XUTLUUPISA-NSynonyms
371213-50-2371213502
CCOC(=O)C1=C(N=C(S1)N2C(C(=C(C3=CC=C(C=C3)C)O)C(=O)C2=O)C4=CC=C(C=C4)OC)C
CCOC(=O)c1sc(nc1C)N1C(c2ccc(cc2)OC)C(=C(c2ccc(cc2)C)O)C(=O)C1=O
ethyl2((3E)3(hydroxy(4methylphenyl)methylidene)2(4methoxyphenyl)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
InChI=1SC26H24N2O6Sc153425(32)2315(3)2726(3523)2820(16101218(334)131116)19(22(30)24(28)31)21(29)178614(2)7917h6132029H5H214H3b2119+
MFCD03801597
ZINC000102800223
ZINC000102800227
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