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

Systemtic Name: [2-oxidanylidene-2-[4-(propanoylamino)phenyl]ethyl] 3-(4-chlorophenyl)sulfanylpropanoate Openeye Name: [2-oxo-2-[4-(propanoylamino)phenyl]ethyl] 3-(4-chlorophenyl)sulfanylpropanoate CAS Name: 3-[(4-chlorophenyl)thio]propanoic acid [2-oxo-2-[4-(1-oxopropylamino)phenyl]ethyl] ester IUPAC Name: [2-oxo-2-[4-(propanoylamino)phenyl]ethyl] 3-(4-chlorophenyl)sulfanylpropanoate Traditional Name: 3-[(4-chlorophenyl)thio]propionic acid [2-keto-2-(4-propionamidophenyl)ethyl] ester Formula: C20H20ClNO4S MolecularWeight: 405.8951

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20ClNO4S/c1-2-19(24)22-16-7-3-14(4-8-16)18(23)13-26-20(25)11-12-27-17-9-5-15(21)6-10-17/h3-10H,2,11-13H2,1H3,(H,22,24)