2-methylsulfanyl-6-[[4-(phenylmethyl)piperidin-1-yl]methyl]pyridine-3-carbonitrile

Systemtic Name: 2-methylsulfanyl-6-[[4-(phenylmethyl)piperidin-1-yl]methyl]pyridine-3-carbonitrile Openeye Name: 6-[(4-benzyl-1-piperidyl)methyl]-2-methylsulfanyl-pyridine-3-carbonitrile CAS Name: 2-(methylthio)-6-[[4-(phenylmethyl)-1-piperidinyl]methyl]-3-pyridinecarbonitrile IUPAC Name: 6-[(4-benzylpiperidin-1-yl)methyl]-2-methylsulfanylpyridine-3-carbonitrile Traditional Name: 6-[(4-benzylpiperidino)methyl]-2-(methylthio)nicotinonitrile Formula: C20H23N3S MolecularWeight: 337.48172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC(=N1)CN2CCC(CC2)CC3=CC=CC=C3)C#N

Isomeric SMILES

CSC1=C(C=CC(=N1)CN2CCC(CC2)CC3=CC=CC=C3)C#N

InChI

InChI=1S/C20H23N3S/c1-24-20-18(14-21)7-8-19(22-20)15-23-11-9-17(10-12-23)13-16-5-3-2-4-6-16/h2-8,17H,9-13,15H2,1H3