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

Systemtic Name: 1-[(4-bromophenyl)methyl]-N-[2-(phenylmethylsulfanyl)ethyl]piperidine-4-carboxamide Openeye Name: N-(2-benzylsulfanylethyl)-1-[(4-bromophenyl)methyl]piperidine-4-carboxamide CAS Name: 1-[(4-bromophenyl)methyl]-N-[2-(phenylmethylthio)ethyl]-4-piperidinecarboxamide IUPAC Name: N-(2-benzylsulfanylethyl)-1-[(4-bromophenyl)methyl]piperidine-4-carboxamide Traditional Name: N-[2-(benzylthio)ethyl]-1-(4-bromobenzyl)isonipecotamide Formula: C22H27BrN2OS MolecularWeight: 447.43158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCSCC2=CC=CC=C2)CC3=CC=C(C=C3)Br

Isomeric SMILES

C1CN(CCC1C(=O)NCCSCC2=CC=CC=C2)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C22H27BrN2OS/c23-21-8-6-18(7-9-21)16-25-13-10-20(11-14-25)22(26)24-12-15-27-17-19-4-2-1-3-5-19/h1-9,20H,10-17H2,(H,24,26)