1-(4-chlorophenyl)carbonyl-N-[2-(4-methylphenyl)sulfanylethyl]piperidine-3-carboxamide

Systemtic Name: 1-(4-chlorophenyl)carbonyl-N-[2-(4-methylphenyl)sulfanylethyl]piperidine-3-carboxamide Openeye Name: 1-(4-chlorobenzoyl)-N-[2-(p-tolylsulfanyl)ethyl]piperidine-3-carboxamide CAS Name: 1-[(4-chlorophenyl)-oxomethyl]-N-[2-[(4-methylphenyl)thio]ethyl]-3-piperidinecarboxamide IUPAC Name: 1-(4-chlorobenzoyl)-N-[2-(4-methylphenyl)sulfanylethyl]piperidine-3-carboxamide Traditional Name: 1-(4-chlorobenzoyl)-N-[2-(p-tolylthio)ethyl]nipecotamide Formula: C22H25ClN2O2S MolecularWeight: 416.9641

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C2CCCN(C2)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)C2CCCN(C2)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H25ClN2O2S/c1-16-4-10-20(11-5-16)28-14-12-24-21(26)18-3-2-13-25(15-18)22(27)17-6-8-19(23)9-7-17/h4-11,18H,2-3,12-15H2,1H3,(H,24,26)