1-[2-(4-methylphenyl)sulfanylpyridin-3-yl]carbonyl-N-phenyl-piperidine-4-carboxamide

Systemtic Name: 1-[2-(4-methylphenyl)sulfanylpyridin-3-yl]carbonyl-N-phenyl-piperidine-4-carboxamide Openeye Name: N-phenyl-1-[2-(p-tolylsulfanyl)pyridine-3-carbonyl]piperidine-4-carboxamide CAS Name: 1-[[2-[(4-methylphenyl)thio]-3-pyridinyl]-oxomethyl]-N-phenyl-4-piperidinecarboxamide IUPAC Name: 1-[2-(4-methylphenyl)sulfanylpyridine-3-carbonyl]-N-phenylpiperidine-4-carboxamide Traditional Name: N-phenyl-1-[2-(p-tolylthio)nicotinoyl]isonipecotamide Formula: C25H25N3O2S MolecularWeight: 431.5499

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=CC=N2)C(=O)N3CCC(CC3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=CC=N2)C(=O)N3CCC(CC3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C25H25N3O2S/c1-18-9-11-21(12-10-18)31-24-22(8-5-15-26-24)25(30)28-16-13-19(14-17-28)23(29)27-20-6-3-2-4-7-20/h2-12,15,19H,13-14,16-17H2,1H3,(H,27,29)