Vitas-M small molecule compound
ethyl 2-[(3E)-3-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-2-(4-hydroxyphenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK566430
SMILES CCOC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccc(c(c2)C)OC)/O)/C1c1ccc(cc1)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 C26H24N2O7S MW 508.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O7S/c1-5-35-25(33)23-14(3)27-26(36-23)28-20(15-6-9-17(29)10-7-15)19(22(31)24(28)32)21(30)16-8-11-18(34-4)13(2)12-16/h6-12,20,29-30H,5H2,1-4H3/b21-19+InChIKey
JIJXVTAWIGGRQO-XUTLUUPISA-NSynonyms
489401-13-0489401130
CCOC(=O)C1=C(N=C(S1)N2C(C(=C(C3=CC(=C(C=C3)OC)C)O)C(=O)C2=O)C4=CC=C(C=C4)O)C
CCOC(=O)c1sc(nc1C)N1C(=O)C(=O)C(=C(c2ccc(c(c2)C)OC)O)C1c1ccc(cc1)O
ethyl2((3E)3(hydroxy(4methoxy3methylphenyl)methylidene)2(4hydroxyphenyl)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
InChI=1SC26H24N2O7Sc153525(33)2314(3)2726(3623)2820(156917(29)10715)19(22(31)24(28)32)21(30)1681118(344)13(2)1216h612202930H5H214H3b2119+
MFCD03803065
ZINC000102541728
ZINC000102541735
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