Vitas-M small molecule compound
2-benzyl 4-ethyl 5-{[(Z)-2-cyano-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]amino}-3-methylthiophene-2,4-dicarboxylate
Catalog ID
STK803924
SMILES CCOC(=O)c1c(N/C=C(\c2scc(n2)c2ccccc2)/C#N)sc(c1C)C(=O)OCc1ccccc1
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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 C28H23N3O4S2 MW 529.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23N3O4S2/c1-3-34-27(32)23-18(2)24(28(33)35-16-19-10-6-4-7-11-19)37-26(23)30-15-21(14-29)25-31-22(17-36-25)20-12-8-5-9-13-20/h4-13,15,17,30H,3,16H2,1-2H3/b21-15-InChIKey
LGDOFMAWJODYNU-QNGOZBTKSA-NSynonyms
843637-48-9(Z)2benzyl4ethyl5((2cyano2(4phenylthiazol2yl)vinyl)amino)3methylthiophene24dicarboxylate
2benzyl4ethyl5(((Z)2cyano2(4phenyl13thiazol2yl)ethenyl)amino)3methylthiophene24dicarboxylate
2OBENZYL4OETHYL5(((Z)2CYANO2(4PHENYL13THIAZOL2YL)ETHENYL)AMINO)3METHYLTHIOPHENE24DICARBOXYLATE
843637489
CCOC(=O)C1=C(SC(=C1C)C(=O)OCC2=CC=CC=C2)NC=C(C#N)C3=NC(=CS3)C4=CC=CC=C4
CCOC(=O)c1c(NC=C(c2scc(n2)c2ccccc2)C#N)sc(c1C)C(=O)OCc1ccccc1
InChI=1SC28H23N3O4S2c133427(32)2318(2)24(28(33)351619106471119)3726(23)301521(1429)253122(173625)20128591320h413151730H316H212H3b2115
MFCD04016260
ZINC000002448186
ZINC2448186
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