1-[(3-bromophenyl)methyl]-N-[2-[(2-chlorophenyl)methylsulfanyl]ethyl]piperidine-3-carboxamide

Systemtic Name: 1-[(3-bromophenyl)methyl]-N-[2-[(2-chlorophenyl)methylsulfanyl]ethyl]piperidine-3-carboxamide Openeye Name: 1-[(3-bromophenyl)methyl]-N-[2-[(2-chlorophenyl)methylsulfanyl]ethyl]piperidine-3-carboxamide CAS Name: 1-[(3-bromophenyl)methyl]-N-[2-[(2-chlorophenyl)methylthio]ethyl]-3-piperidinecarboxamide IUPAC Name: 1-[(3-bromophenyl)methyl]-N-[2-[(2-chlorophenyl)methylsulfanyl]ethyl]piperidine-3-carboxamide Traditional Name: 1-(3-bromobenzyl)-N-[2-[(2-chlorobenzyl)thio]ethyl]nipecotamide Formula: C22H26BrClN2OS MolecularWeight: 481.87664

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC(=CC=C2)Br)C(=O)NCCSCC3=CC=CC=C3Cl

Isomeric SMILES

C1CC(CN(C1)CC2=CC(=CC=C2)Br)C(=O)NCCSCC3=CC=CC=C3Cl

InChI

InChI=1S/C22H26BrClN2OS/c23-20-8-3-5-17(13-20)14-26-11-4-7-18(15-26)22(27)25-10-12-28-16-19-6-1-2-9-21(19)24/h1-3,5-6,8-9,13,18H,4,7,10-12,14-16H2,(H,25,27)