[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] (Z)-3-(4-fluorophenyl)-2-thiophen-2-yl-prop-2-enoate

Systemtic Name: [2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] (Z)-3-(4-fluorophenyl)-2-thiophen-2-yl-prop-2-enoate Openeye Name: [2-(2-methylsulfanylanilino)-2-oxo-ethyl] (Z)-3-(4-fluorophenyl)-2-(2-thienyl)prop-2-enoate CAS Name: (Z)-3-(4-fluorophenyl)-2-thiophen-2-yl-2-propenoic acid [2-[2-(methylthio)anilino]-2-oxoethyl] ester IUPAC Name: [2-(2-methylsulfanylanilino)-2-oxoethyl] (Z)-3-(4-fluorophenyl)-2-thiophen-2-ylprop-2-enoate Traditional Name: (Z)-3-(4-fluorophenyl)-2-(2-thienyl)acrylic acid [2-keto-2-[2-(methylthio)anilino]ethyl] ester Formula: C22H18FNO3S2 MolecularWeight: 427.511623

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)COC(=O)C(=CC2=CC=C(C=C2)F)C3=CC=CS3

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)COC(=O)/C(=C/C2=CC=C(C=C2)F)/C3=CC=CS3

InChI

InChI=1S/C22H18FNO3S2/c1-28-20-6-3-2-5-18(20)24-21(25)14-27-22(26)17(19-7-4-12-29-19)13-15-8-10-16(23)11-9-15/h2-13H,14H2,1H3,(H,24,25)/b17-13+