1-[(3-chlorophenyl)methyl]-N-[4-(phenylsulfanylmethyl)phenyl]piperidine-3-carboxamide

Systemtic Name: 1-[(3-chlorophenyl)methyl]-N-[4-(phenylsulfanylmethyl)phenyl]piperidine-3-carboxamide Openeye Name: 1-[(3-chlorophenyl)methyl]-N-[4-(phenylsulfanylmethyl)phenyl]piperidine-3-carboxamide CAS Name: 1-[(3-chlorophenyl)methyl]-N-[4-[(phenylthio)methyl]phenyl]-3-piperidinecarboxamide IUPAC Name: 1-[(3-chlorophenyl)methyl]-N-[4-(phenylsulfanylmethyl)phenyl]piperidine-3-carboxamide Traditional Name: 1-(3-chlorobenzyl)-N-[4-[(phenylthio)methyl]phenyl]nipecotamide Formula: C26H27ClN2OS MolecularWeight: 451.02338

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC(=CC=C2)Cl)C(=O)NC3=CC=C(C=C3)CSC4=CC=CC=C4

Isomeric SMILES

C1CC(CN(C1)CC2=CC(=CC=C2)Cl)C(=O)NC3=CC=C(C=C3)CSC4=CC=CC=C4

InChI

InChI=1S/C26H27ClN2OS/c27-23-8-4-6-21(16-23)17-29-15-5-7-22(18-29)26(30)28-24-13-11-20(12-14-24)19-31-25-9-2-1-3-10-25/h1-4,6,8-14,16,22H,5,7,15,17-19H2,(H,28,30)