[2-oxidanylidene-2-[4-(propanoylamino)phenyl]ethyl] 3-(4-methylphenyl)sulfanylpropanoate

Systemtic Name: [2-oxidanylidene-2-[4-(propanoylamino)phenyl]ethyl] 3-(4-methylphenyl)sulfanylpropanoate Openeye Name: [2-oxo-2-[4-(propanoylamino)phenyl]ethyl] 3-(p-tolylsulfanyl)propanoate CAS Name: 3-[(4-methylphenyl)thio]propanoic acid [2-oxo-2-[4-(1-oxopropylamino)phenyl]ethyl] ester IUPAC Name: [2-oxo-2-[4-(propanoylamino)phenyl]ethyl] 3-(4-methylphenyl)sulfanylpropanoate Traditional Name: 3-(p-tolylthio)propionic acid [2-keto-2-(4-propionamidophenyl)ethyl] ester Formula: C21H23NO4S MolecularWeight: 385.47662

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)CCSC2=CC=C(C=C2)C

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)CCSC2=CC=C(C=C2)C

InChI

InChI=1S/C21H23NO4S/c1-3-20(24)22-17-8-6-16(7-9-17)19(23)14-26-21(25)12-13-27-18-10-4-15(2)5-11-18/h4-11H,3,12-14H2,1-2H3,(H,22,24)