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

Systemtic Name: N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-1-[(4-methylphenyl)methyl]piperidine-4-carboxamide Openeye Name: N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-1-(p-tolylmethyl)piperidine-4-carboxamide CAS Name: N-[2-[(4-chlorophenyl)methylthio]ethyl]-1-[(4-methylphenyl)methyl]-4-piperidinecarboxamide IUPAC Name: N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-1-[(4-methylphenyl)methyl]piperidine-4-carboxamide Traditional Name: N-[2-[(4-chlorobenzyl)thio]ethyl]-1-(4-methylbenzyl)isonipecotamide Formula: C23H29ClN2OS MolecularWeight: 417.00716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCC(CC2)C(=O)NCCSCC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCC(CC2)C(=O)NCCSCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H29ClN2OS/c1-18-2-4-19(5-3-18)16-26-13-10-21(11-14-26)23(27)25-12-15-28-17-20-6-8-22(24)9-7-20/h2-9,21H,10-17H2,1H3,(H,25,27)