2-methylsulfanyl-N-[[1-(phenylmethyl)piperidin-4-yl]methyl]pyridine-3-carboxamide

Systemtic Name: 2-methylsulfanyl-N-[[1-(phenylmethyl)piperidin-4-yl]methyl]pyridine-3-carboxamide Openeye Name: N-[(1-benzyl-4-piperidyl)methyl]-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: 2-(methylthio)-N-[[1-(phenylmethyl)-4-piperidinyl]methyl]-3-pyridinecarboxamide IUPAC Name: N-[(1-benzylpiperidin-4-yl)methyl]-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-[(1-benzyl-4-piperidyl)methyl]-2-(methylthio)nicotinamide Formula: C20H25N3OS MolecularWeight: 355.497

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)NCC2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)NCC2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H25N3OS/c1-25-20-18(8-5-11-21-20)19(24)22-14-16-9-12-23(13-10-16)15-17-6-3-2-4-7-17/h2-8,11,16H,9-10,12-15H2,1H3,(H,22,24)