Vitas-M small molecule compound
ethyl (5Z)-5-{[5-(4-chlorophenyl)furan-2-yl]methylidene}-2-{[(4-methylphenyl)carbonyl]amino}-4-oxo-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STL371534
SMILES CCOC(=O)C1=C(NC(=O)c2ccc(cc2)C)S/C(=C\c2ccc(o2)c2ccc(cc2)Cl)/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 C26H20ClNO5S MW 493.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20ClNO5S/c1-3-32-26(31)22-23(29)21(34-25(22)28-24(30)17-6-4-15(2)5-7-17)14-19-12-13-20(33-19)16-8-10-18(27)11-9-16/h4-14H,3H2,1-2H3,(H,28,30)/b21-14-InChIKey
AUIQCHWBEAERQW-STZFKDTASA-NSynonyms
CCOC(=O)C1=C(NC(=O)c2ccc(cc2)C)SC(=Cc2ccc(o2)c2ccc(cc2)Cl)C1=O
CCOC(=O)C1=C(SC(=CC2=CC=C(O2)C3=CC=C(C=C3)Cl)C1=O)NC(=O)C4=CC=C(C=C4)C
ethyl(5Z)5((5(4chlorophenyl)furan2yl)methylidene)2(((4methylphenyl)carbonyl)amino)4oxo45dihydrothiophene3carboxylate
ETHYL(5Z)5((5(4CHLOROPHENYL)FURAN2YL)METHYLIDENE)2((4METHYLBENZOYL)AMINO)4OXOTHIOPHENE3CARBOXYLATE
InChI=1SC26H20ClNO5Sc133226(31)2223(29)21(3425(22)2824(30)176415(2)5717)1419121320(3319)1681018(27)11916h414H3H212H3(H2830)b2114
MFCD03711098
ZINC000006227920
ZINC06227920
ZINC6227920
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