methyl 4-[2-(3-chloranyl-4-fluoranyl-phenyl)sulfanylethanoylamino]benzoate

Systemtic Name: methyl 4-[2-(3-chloranyl-4-fluoranyl-phenyl)sulfanylethanoylamino]benzoate Openeye Name: methyl 4-[[2-(3-chloro-4-fluoro-phenyl)sulfanylacetyl]amino]benzoate CAS Name: 4-[[2-[(3-chloro-4-fluorophenyl)thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(3-chloro-4-fluorophenyl)sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[(3-chloro-4-fluoro-phenyl)thio]acetyl]amino]benzoic acid methyl ester Formula: C16H13ClFNO3S MolecularWeight: 353.795723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13ClFNO3S/c1-22-16(21)10-2-4-11(5-3-10)19-15(20)9-23-12-6-7-14(18)13(17)8-12/h2-8H,9H2,1H3,(H,19,20)