2-(cyclohexylmethylsulfanyl)-6-(4-methylphenyl)-4-phenyl-pyridine-3-carbonitrile

Systemtic Name: 2-(cyclohexylmethylsulfanyl)-6-(4-methylphenyl)-4-phenyl-pyridine-3-carbonitrile Openeye Name: 2-(cyclohexylmethylsulfanyl)-4-phenyl-6-(p-tolyl)pyridine-3-carbonitrile CAS Name: 2-(cyclohexylmethylthio)-6-(4-methylphenyl)-4-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-(cyclohexylmethylsulfanyl)-6-(4-methylphenyl)-4-phenylpyridine-3-carbonitrile Traditional Name: 2-(cyclohexylmethylthio)-4-phenyl-6-(p-tolyl)nicotinonitrile Formula: C26H26N2S MolecularWeight: 398.56304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCC4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCC4CCCCC4

InChI

InChI=1S/C26H26N2S/c1-19-12-14-22(15-13-19)25-16-23(21-10-6-3-7-11-21)24(17-27)26(28-25)29-18-20-8-4-2-5-9-20/h3,6-7,10-16,20H,2,4-5,8-9,18H2,1H3