ethyl 4-[3-(4-methylphenyl)sulfanylpropanoylamino]benzoate

Systemtic Name: ethyl 4-[3-(4-methylphenyl)sulfanylpropanoylamino]benzoate Openeye Name: ethyl 4-[3-(p-tolylsulfanyl)propanoylamino]benzoate CAS Name: 4-[[3-[(4-methylphenyl)thio]-1-oxopropyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-(4-methylphenyl)sulfanylpropanoylamino]benzoate Traditional Name: 4-[3-(p-tolylthio)propanoylamino]benzoic acid ethyl ester Formula: C19H21NO3S MolecularWeight: 343.43994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCSC2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCSC2=CC=C(C=C2)C

InChI

InChI=1S/C19H21NO3S/c1-3-23-19(22)15-6-8-16(9-7-15)20-18(21)12-13-24-17-10-4-14(2)5-11-17/h4-11H,3,12-13H2,1-2H3,(H,20,21)