1-[(4-bromophenyl)methyl]-N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]piperidine-4-carboxamide

Systemtic Name: 1-[(4-bromophenyl)methyl]-N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]piperidine-4-carboxamide Openeye Name: 1-[(4-bromophenyl)methyl]-N-[2-(p-tolylmethylsulfanyl)ethyl]piperidine-4-carboxamide CAS Name: 1-[(4-bromophenyl)methyl]-N-[2-[(4-methylphenyl)methylthio]ethyl]-4-piperidinecarboxamide IUPAC Name: 1-[(4-bromophenyl)methyl]-N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]piperidine-4-carboxamide Traditional Name: 1-(4-bromobenzyl)-N-[2-[(4-methylbenzyl)thio]ethyl]isonipecotamide Formula: C23H29BrN2OS MolecularWeight: 461.45816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCCNC(=O)C2CCN(CC2)CC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)CSCCNC(=O)C2CCN(CC2)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C23H29BrN2OS/c1-18-2-4-20(5-3-18)17-28-15-12-25-23(27)21-10-13-26(14-11-21)16-19-6-8-22(24)9-7-19/h2-9,21H,10-17H2,1H3,(H,25,27)