Vitas-M small molecule compound
methyl (5E)-5-(4-fluorobenzylidene)-4-oxo-2-(phenylamino)-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STK015446
SMILES COC(=O)C1=C(Nc2ccccc2)S/C(=C/c2ccc(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 C19H14FNO3S MW 355.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14FNO3S/c1-24-19(23)16-17(22)15(11-12-7-9-13(20)10-8-12)25-18(16)21-14-5-3-2-4-6-14/h2-11,21H,1H3/b15-11+InChIKey
ZFXGOHGKSCGMGZ-RVDMUPIBSA-NSynonyms
COC(=O)C1=C(Nc2ccccc2)SC(=Cc2ccc(cc2)F)C1=O
COC(=O)C1=C(SC(=CC2=CC=C(C=C2)F)C1=O)NC3=CC=CC=C3
InChI=1SC19H14FNO3Sc12419(23)1617(22)15(11127913(20)10812)2518(16)21145324614h21121H1H3b1511+
METHYL(5E)2ANILINO5((4FLUOROPHENYL)METHYLIDENE)4OXOTHIOPHENE3CARBOXYLATE
METHYL(5E)5(4FLUOROBENZYLIDENE)4OXO2(PHENYLAMINO)45DIHYDROTHIOPHENE3CARBOXYLATE
MFCD08049599
STK015446
ZINC000001144683
ZINC01144683
ZINC1144683
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