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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCCNC(=O)C2CCN(CC2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(C=C1)CSCCNC(=O)C2CCN(CC2)CC3=CC=CC4=CC=CC=C43

InChI

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