[2-oxidanylidene-2-(3-phenylpropylamino)ethyl] 3-(2-chlorophenyl)sulfanylpropanoate

Systemtic Name: [2-oxidanylidene-2-(3-phenylpropylamino)ethyl] 3-(2-chlorophenyl)sulfanylpropanoate Openeye Name: [2-oxo-2-(3-phenylpropylamino)ethyl] 3-(2-chlorophenyl)sulfanylpropanoate CAS Name: 3-[(2-chlorophenyl)thio]propanoic acid [2-oxo-2-(3-phenylpropylamino)ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylpropylamino)ethyl] 3-(2-chlorophenyl)sulfanylpropanoate Traditional Name: 3-[(2-chlorophenyl)thio]propionic acid [2-keto-2-(3-phenylpropylamino)ethyl] ester Formula: C20H22ClNO3S MolecularWeight: 391.91158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC(=O)COC(=O)CCSC2=CC=CC=C2Cl

Isomeric SMILES

C1=CC=C(C=C1)CCCNC(=O)COC(=O)CCSC2=CC=CC=C2Cl

InChI

InChI=1S/C20H22ClNO3S/c21-17-10-4-5-11-18(17)26-14-12-20(24)25-15-19(23)22-13-6-9-16-7-2-1-3-8-16/h1-5,7-8,10-11H,6,9,12-15H2,(H,22,23)