N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide

Systemtic Name: N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide Openeye Name: 1-(1-naphthylmethyl)-N-[2-(p-tolylmethylsulfanyl)ethyl]piperidine-3-carboxamide CAS Name: N-[2-[(4-methylphenyl)methylthio]ethyl]-1-(1-naphthalenylmethyl)-3-piperidinecarboxamide IUPAC Name: N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide Traditional Name: N-[2-[(4-methylbenzyl)thio]ethyl]-1-(1-naphthylmethyl)nipecotamide Formula: C27H32N2OS MolecularWeight: 432.62078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCCNC(=O)C2CCCN(C2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(C=C1)CSCCNC(=O)C2CCCN(C2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C27H32N2OS/c1-21-11-13-22(14-12-21)20-31-17-15-28-27(30)25-9-5-16-29(19-25)18-24-8-4-7-23-6-2-3-10-26(23)24/h2-4,6-8,10-14,25H,5,9,15-20H2,1H3,(H,28,30)