1-[(4-methylphenyl)methyl]-N-[2-(phenylmethylsulfanyl)ethyl]piperidine-3-carboxamide

Systemtic Name: 1-[(4-methylphenyl)methyl]-N-[2-(phenylmethylsulfanyl)ethyl]piperidine-3-carboxamide Openeye Name: N-(2-benzylsulfanylethyl)-1-(p-tolylmethyl)piperidine-3-carboxamide CAS Name: 1-[(4-methylphenyl)methyl]-N-[2-(phenylmethylthio)ethyl]-3-piperidinecarboxamide IUPAC Name: N-(2-benzylsulfanylethyl)-1-[(4-methylphenyl)methyl]piperidine-3-carboxamide Traditional Name: N-[2-(benzylthio)ethyl]-1-(4-methylbenzyl)nipecotamide Formula: C23H30N2OS MolecularWeight: 382.5621

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCCC(C2)C(=O)NCCSCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCCC(C2)C(=O)NCCSCC3=CC=CC=C3

InChI

InChI=1S/C23H30N2OS/c1-19-9-11-20(12-10-19)16-25-14-5-8-22(17-25)23(26)24-13-15-27-18-21-6-3-2-4-7-21/h2-4,6-7,9-12,22H,5,8,13-18H2,1H3,(H,24,26)