methyl 3-[[2-[(2-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylmethyl]benzoate

Systemtic Name: methyl 3-[[2-[(2-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylmethyl]benzoate Openeye Name: methyl 3-[[2-(2-fluoroanilino)-2-oxo-ethyl]sulfanylmethyl]benzoate CAS Name: 3-[[[2-(2-fluoroanilino)-2-oxoethyl]thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(2-fluoroanilino)-2-oxoethyl]sulfanylmethyl]benzoate Traditional Name: 3-[[[2-(2-fluoroanilino)-2-keto-ethyl]thio]methyl]benzoic acid methyl ester Formula: C17H16FNO3S MolecularWeight: 333.377243

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)CSCC(=O)NC2=CC=CC=C2F

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)CSCC(=O)NC2=CC=CC=C2F

InChI

InChI=1S/C17H16FNO3S/c1-22-17(21)13-6-4-5-12(9-13)10-23-11-16(20)19-15-8-3-2-7-14(15)18/h2-9H,10-11H2,1H3,(H,19,20)