N-[3-[(4-chlorophenyl)methylsulfanyl]propyl]-1-[(3-methylphenyl)methyl]piperidine-4-carboxamide

Systemtic Name: N-[3-[(4-chlorophenyl)methylsulfanyl]propyl]-1-[(3-methylphenyl)methyl]piperidine-4-carboxamide Openeye Name: N-[3-[(4-chlorophenyl)methylsulfanyl]propyl]-1-(m-tolylmethyl)piperidine-4-carboxamide CAS Name: N-[3-[(4-chlorophenyl)methylthio]propyl]-1-[(3-methylphenyl)methyl]-4-piperidinecarboxamide IUPAC Name: N-[3-[(4-chlorophenyl)methylsulfanyl]propyl]-1-[(3-methylphenyl)methyl]piperidine-4-carboxamide Traditional Name: N-[3-[(4-chlorobenzyl)thio]propyl]-1-(3-methylbenzyl)isonipecotamide Formula: C24H31ClN2OS MolecularWeight: 431.03374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCC(CC2)C(=O)NCCCSCC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCC(CC2)C(=O)NCCCSCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C24H31ClN2OS/c1-19-4-2-5-21(16-19)17-27-13-10-22(11-14-27)24(28)26-12-3-15-29-18-20-6-8-23(25)9-7-20/h2,4-9,16,22H,3,10-15,17-18H2,1H3,(H,26,28)