1-[(4-methylphenyl)methyl]-N-[4-(phenylsulfanylmethyl)phenyl]piperidine-3-carboxamide

Systemtic Name: 1-[(4-methylphenyl)methyl]-N-[4-(phenylsulfanylmethyl)phenyl]piperidine-3-carboxamide Openeye Name: N-[4-(phenylsulfanylmethyl)phenyl]-1-(p-tolylmethyl)piperidine-3-carboxamide CAS Name: 1-[(4-methylphenyl)methyl]-N-[4-[(phenylthio)methyl]phenyl]-3-piperidinecarboxamide IUPAC Name: 1-[(4-methylphenyl)methyl]-N-[4-(phenylsulfanylmethyl)phenyl]piperidine-3-carboxamide Traditional Name: 1-(4-methylbenzyl)-N-[4-[(phenylthio)methyl]phenyl]nipecotamide Formula: C27H30N2OS MolecularWeight: 430.6049

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCCC(C2)C(=O)NC3=CC=C(C=C3)CSC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCCC(C2)C(=O)NC3=CC=C(C=C3)CSC4=CC=CC=C4

InChI

InChI=1S/C27H30N2OS/c1-21-9-11-22(12-10-21)18-29-17-5-6-24(19-29)27(30)28-25-15-13-23(14-16-25)20-31-26-7-3-2-4-8-26/h2-4,7-16,24H,5-6,17-20H2,1H3,(H,28,30)