2,6-dimethyl-4-(phenylmethylsulfanyl)pyridine-3-carbonitrile

Systemtic Name: 2,6-dimethyl-4-(phenylmethylsulfanyl)pyridine-3-carbonitrile Openeye Name: 4-benzylsulfanyl-2,6-dimethyl-pyridine-3-carbonitrile CAS Name: 2,6-dimethyl-4-(phenylmethylthio)-3-pyridinecarbonitrile IUPAC Name: 4-benzylsulfanyl-2,6-dimethylpyridine-3-carbonitrile Traditional Name: 4-(benzylthio)-2,6-dimethyl-nicotinonitrile Formula: C15H14N2S MolecularWeight: 254.35006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)SCC2=CC=CC=C2)C#N)C

Isomeric SMILES

CC1=NC(=C(C(=C1)SCC2=CC=CC=C2)C#N)C

InChI

InChI=1S/C15H14N2S/c1-11-8-15(14(9-16)12(2)17-11)18-10-13-6-4-3-5-7-13/h3-8H,10H2,1-2H3