methyl 4-[2-(4-fluorophenyl)sulfanylethanoylamino]benzoate

Systemtic Name: methyl 4-[2-(4-fluorophenyl)sulfanylethanoylamino]benzoate Openeye Name: methyl 4-[[2-(4-fluorophenyl)sulfanylacetyl]amino]benzoate CAS Name: 4-[[2-[(4-fluorophenyl)thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(4-fluorophenyl)sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[(4-fluorophenyl)thio]acetyl]amino]benzoic acid methyl ester Formula: C16H14FNO3S MolecularWeight: 319.350663

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=CC=C(C=C2)F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=CC=C(C=C2)F

InChI

InChI=1S/C16H14FNO3S/c1-21-16(20)11-2-6-13(7-3-11)18-15(19)10-22-14-8-4-12(17)5-9-14/h2-9H,10H2,1H3,(H,18,19)