Vitas-M small molecule compound
ethyl (5Z)-5-{2-[(4-fluorobenzyl)oxy]benzylidene}-2-[(4-methylphenyl)amino]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STK015646
SMILES CCOC(=O)C1=C(Nc2ccc(cc2)C)S/C(=C\c2ccccc2OCc2ccc(cc2)F)/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 C28H24FNO4S MW 489.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24FNO4S/c1-3-33-28(32)25-26(31)24(35-27(25)30-22-14-8-18(2)9-15-22)16-20-6-4-5-7-23(20)34-17-19-10-12-21(29)13-11-19/h4-16,30H,3,17H2,1-2H3/b24-16-InChIKey
VIUYTRKALLDGEL-JLPGSUDCSA-NSynonyms
CCOC(=O)C1=C(Nc2ccc(cc2)C)SC(=Cc2ccccc2OCc2ccc(cc2)F)C1=O
CCOC(=O)C1=C(SC(=CC2=CC=CC=C2OCC3=CC=C(C=C3)F)C1=O)NC4=CC=C(C=C4)C
ETHYL(5Z)5((2((4FLUOROPHENYL)METHOXY)PHENYL)METHYLIDENE)2(4METHYLANILINO)4OXOTHIOPHENE3CARBOXYLATE
ETHYL(5Z)5(2((4FLUOROBENZYL)OXY)BENZYLIDENE)2((4METHYLPHENYL)AMINO)4OXO45DIHYDROTHIOPHENE3CARBOXYLATE
ETHYL5(2((4FLUOROBENZYL)OXY)BENZYLIDENE)4OXO2(4TOLUIDINO)45DIHYDRO3THIOPHENECARBOXYLATE
InChI=1SC28H24FNO4Sc133328(32)2526(31)24(3527(25)302214818(2)91522)1620645723(20)341719101221(29)131119h41630H317H212H3b2416
MFCD02221650
STK015646
ZINC000006378683
ZINC06378683
ZINC6378683
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