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

Systemtic Name: methyl 4-[2-(2-methylphenyl)sulfanylethanoylamino]benzoate Openeye Name: methyl 4-[[2-(o-tolylsulfanyl)acetyl]amino]benzoate CAS Name: 4-[[2-[(2-methylphenyl)thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(2-methylphenyl)sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-(o-tolylthio)acetyl]amino]benzoic acid methyl ester Formula: C17H17NO3S MolecularWeight: 315.38678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)NC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)NC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C17H17NO3S/c1-12-5-3-4-6-15(12)22-11-16(19)18-14-9-7-13(8-10-14)17(20)21-2/h3-10H,11H2,1-2H3,(H,18,19)