Vitas-M small molecule compound
ethyl (5E)-5-(4-hydroxybenzylidene)-4-oxo-2-(phenylamino)-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STK067322
SMILES CCOC(=O)C1=C(Nc2ccccc2)S/C(=C/c2ccc(cc2)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 C20H17NO4S MW 367.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17NO4S/c1-2-25-20(24)17-18(23)16(12-13-8-10-15(22)11-9-13)26-19(17)21-14-6-4-3-5-7-14/h3-12,21-22H,2H2,1H3/b16-12+InChIKey
ITARRCLTLIMJBH-FOWTUZBSSA-NSynonyms
CCOC(=O)C1=C(Nc2ccccc2)SC(=Cc2ccc(cc2)O)C1=O
CCOC(=O)C1=C(SC(=CC2=CC=C(C=C2)O)C1=O)NC3=CC=CC=C3
ethyl(5E)2anilino5((4hydroxyphenyl)methylidene)4oxothiophene3carboxylate
ETHYL(5E)5(4HYDROXYBENZYLIDENE)4OXO2(PHENYLAMINO)45DIHYDROTHIOPHENE3CARBOXYLATE
InChI=1SC20H17NO4Sc122520(24)1718(23)16(121381015(22)11913)2619(17)21146435714h3122122H2H21H3b1612+
MFCD08051818
STK067322
ZINC000001212603
ZINC01212603
ZINC1212603
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