Vitas-M small molecule compound
ethyl 2-[(3E)-3-[hydroxy(4-methoxy-2-methylphenyl)methylidene]-2-(4-hydroxyphenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK563948
SMILES CCOC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccc(cc2C)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(15-6-8-16(29)9-7-15)19(22(31)24(28)32)21(30)18-11-10-17(34-4)12-13(18)2/h6-12,20,29-30H,5H2,1-4H3/b21-19+InChIKey
LQLRWLRZCBGAFF-XUTLUUPISA-NSynonyms
385417-01-6385417016
CCOC(=O)C1=C(N=C(S1)N2C(C(=C(C3=C(C=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(cc2C)OC)O)C1c1ccc(cc1)O
ethyl2((3E)3(hydroxy(4methoxy2methylphenyl)methylidene)2(4hydroxyphenyl)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
InChI=1SC26H24N2O7Sc153525(33)2314(3)2726(3623)2820(156816(29)9715)19(22(31)24(28)32)21(30)18111017(344)1213(18)2h612202930H5H214H3b2119+
MFCD03796526
ZINC000102524731
ZINC000102524737
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