Vitas-M small molecule compound
prop-2-en-1-yl 2-[(3E)-3-[hydroxy(4-methoxy-2-methylphenyl)methylidene]-2-(4-methylphenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK560348
SMILES C=CCOC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccc(cc2C)OC)/O)/C1c1ccc(cc1)C
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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 C28H26N2O6S MW 518.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N2O6S/c1-6-13-36-27(34)25-17(4)29-28(37-25)30-22(18-9-7-15(2)8-10-18)21(24(32)26(30)33)23(31)20-12-11-19(35-5)14-16(20)3/h6-12,14,22,31H,1,13H2,2-5H3/b23-21+InChIKey
BWFPGFSAFLPNIV-XTQSDGFTSA-NSynonyms
489463-20-9489463209
C=CCOC(=O)c1sc(nc1C)N1C(=O)C(=O)C(=C(c2ccc(cc2C)OC)O)C1c1ccc(cc1)C
CC1=CC=C(C=C1)C2C(=C(C3=C(C=C(C=C3)OC)C)O)C(=O)C(=O)N2C4=NC(=C(S4)C(=O)OCC=C)C
InChI=1SC28H26N2O6Sc16133627(34)2517(4)2928(3725)3022(189715(2)81018)21(24(32)26(30)33)23(31)20121119(355)1416(20)3h612142231H113H225H3b2321+
MFCD03795484
prop2en1yl2((3E)3(hydroxy(4methoxy2methylphenyl)methylidene)2(4methylphenyl)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
PROP2ENYL2((3E)3(HYDROXY(4METHOXY2METHYLPHENYL)METHYLIDENE)2(4METHYLPHENYL)45DIOXOPYRROLIDIN1YL)4METHYL13THIAZOLE5CARBOXYLATE
ZINC000101276769
ZINC000101276771
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