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

Systemtic Name: methyl 4-fluoranyl-3-[2-(4-methylphenyl)sulfanylethanoylamino]benzoate Openeye Name: methyl 4-fluoro-3-[[2-(p-tolylsulfanyl)acetyl]amino]benzoate CAS Name: 4-fluoro-3-[[2-[(4-methylphenyl)thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-fluoro-3-[[2-(4-methylphenyl)sulfanylacetyl]amino]benzoate Traditional Name: 4-fluoro-3-[[2-(p-tolylthio)acetyl]amino]benzoic acid methyl ester Formula: C17H16FNO3S MolecularWeight: 333.377243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)NC2=C(C=CC(=C2)C(=O)OC)F

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)NC2=C(C=CC(=C2)C(=O)OC)F

InChI

InChI=1S/C17H16FNO3S/c1-11-3-6-13(7-4-11)23-10-16(20)19-15-9-12(17(21)22-2)5-8-14(15)18/h3-9H,10H2,1-2H3,(H,19,20)