Vitas-M small molecule compound
ethyl (5Z)-5-(4-chlorobenzylidene)-2-[(4-fluorophenyl)amino]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STK158464
SMILES CCOC(=O)C1=C(Nc2ccc(cc2)F)S/C(=C\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 C20H15ClFNO3S MW 403.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15ClFNO3S/c1-2-26-20(25)17-18(24)16(11-12-3-5-13(21)6-4-12)27-19(17)23-15-9-7-14(22)8-10-15/h3-11,23H,2H2,1H3/b16-11-InChIKey
XYGQNTNLRMXITJ-WJDWOHSUSA-NSynonyms
CCOC(=O)C1=C(Nc2ccc(cc2)F)SC(=Cc2ccc(cc2)Cl)C1=O
CCOC(=O)C1=C(SC(=CC2=CC=C(C=C2)Cl)C1=O)NC3=CC=C(C=C3)F
ETHYL(5Z)5((4CHLOROPHENYL)METHYLIDENE)2(4FLUOROANILINO)4OXOTHIOPHENE3CARBOXYLATE
ETHYL(5Z)5(4CHLOROBENZYLIDENE)2((4FLUOROPHENYL)AMINO)4OXO45DIHYDROTHIOPHENE3CARBOXYLATE
InChI=1SC20H15ClFNO3Sc122620(25)1718(24)16(11123513(21)6412)2719(17)23159714(22)81015h31123H2H21H3b1611
MFCD03711214
ZINC000004696120
ZINC04696120
ZINC4696120
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