[2-[(2-methylphenyl)methylsulfanyl]pyridin-3-yl]-[4-(phenylmethyl)piperidin-1-yl]methanone

Systemtic Name: [2-[(2-methylphenyl)methylsulfanyl]pyridin-3-yl]-[4-(phenylmethyl)piperidin-1-yl]methanone Openeye Name: (4-benzyl-1-piperidyl)-[2-(o-tolylmethylsulfanyl)-3-pyridyl]methanone CAS Name: [2-[(2-methylphenyl)methylthio]-3-pyridinyl]-[4-(phenylmethyl)-1-piperidinyl]methanone IUPAC Name: (4-benzylpiperidin-1-yl)-[2-[(2-methylphenyl)methylsulfanyl]pyridin-3-yl]methanone Traditional Name: (4-benzylpiperidino)-[2-[(2-methylbenzyl)thio]-3-pyridyl]methanone Formula: C26H28N2OS MolecularWeight: 416.57832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=C(C=CC=N2)C(=O)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1CSC2=C(C=CC=N2)C(=O)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H28N2OS/c1-20-8-5-6-11-23(20)19-30-25-24(12-7-15-27-25)26(29)28-16-13-22(14-17-28)18-21-9-3-2-4-10-21/h2-12,15,22H,13-14,16-19H2,1H3