Vitas-M small molecule compound
ethyl (5Z)-5-{2-[(3-fluorobenzyl)oxy]benzylidene}-2-[(4-methylphenyl)amino]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STK002165
SMILES CCOC(=O)C1=C(Nc2ccc(cc2)C)S/C(=C\c2ccccc2OCc2cccc(c2)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)30-22-13-11-18(2)12-14-22)16-20-8-4-5-10-23(20)34-17-19-7-6-9-21(29)15-19/h4-16,30H,3,17H2,1-2H3/b24-16-InChIKey
FWONCGPYXGKSJH-JLPGSUDCSA-NSynonyms
CCOC(=O)C1=C(Nc2ccc(cc2)C)SC(=Cc2ccccc2OCc2cccc(c2)F)C1=O
CCOC(=O)C1=C(SC(=CC2=CC=CC=C2OCC3=CC(=CC=C3)F)C1=O)NC4=CC=C(C=C4)C
ETHYL(5Z)5((2((3FLUOROPHENYL)METHOXY)PHENYL)METHYLIDENE)2(4METHYLANILINO)4OXOTHIOPHENE3CARBOXYLATE
ETHYL(5Z)5(2((3FLUOROBENZYL)OXY)BENZYLIDENE)2((4METHYLPHENYL)AMINO)4OXO45DIHYDROTHIOPHENE3CARBOXYLATE
ETHYL5(2((3FLUOROBENZYL)OXY)BENZYLIDENE)4OXO2(4TOLUIDINO)45DIHYDRO3THIOPHENECARBOXYLATE
InChI=1SC28H24FNO4Sc133328(32)2526(31)24(3527(25)3022131118(2)121422)16208451023(20)34171976921(29)1519h41630H317H212H3b2416
MFCD02953953
STK002165
ZINC000008438453
ZINC08438453
ZINC8438453
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