1-(4-chlorophenyl)carbonyl-N-[1-(4-methylsulfanylphenyl)ethyl]piperidine-3-carboxamide

Systemtic Name: 1-(4-chlorophenyl)carbonyl-N-[1-(4-methylsulfanylphenyl)ethyl]piperidine-3-carboxamide Openeye Name: 1-(4-chlorobenzoyl)-N-[1-(4-methylsulfanylphenyl)ethyl]piperidine-3-carboxamide CAS Name: 1-[(4-chlorophenyl)-oxomethyl]-N-[1-[4-(methylthio)phenyl]ethyl]-3-piperidinecarboxamide IUPAC Name: 1-(4-chlorobenzoyl)-N-[1-(4-methylsulfanylphenyl)ethyl]piperidine-3-carboxamide Traditional Name: 1-(4-chlorobenzoyl)-N-[1-[4-(methylthio)phenyl]ethyl]nipecotamide Formula: C22H25ClN2O2S MolecularWeight: 416.9641

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)SC)NC(=O)C2CCCN(C2)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C1=CC=C(C=C1)SC)NC(=O)C2CCCN(C2)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H25ClN2O2S/c1-15(16-7-11-20(28-2)12-8-16)24-21(26)18-4-3-13-25(14-18)22(27)17-5-9-19(23)10-6-17/h5-12,15,18H,3-4,13-14H2,1-2H3,(H,24,26)