2-cyclohexyl-2-pyridin-2-ylsulfanyl-ethanenitrile

Systemtic Name: 2-cyclohexyl-2-pyridin-2-ylsulfanyl-ethanenitrile Openeye Name: 2-cyclohexyl-2-(2-pyridylsulfanyl)acetonitrile CAS Name: 2-cyclohexyl-2-(2-pyridinylthio)acetonitrile IUPAC Name: 2-cyclohexyl-2-pyridin-2-ylsulfanylacetonitrile Traditional Name: 2-cyclohexyl-2-(2-pyridylthio)acetonitrile Formula: C13H16N2S MolecularWeight: 232.34454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C#N)SC2=CC=CC=N2

Isomeric SMILES

C1CCC(CC1)C(C#N)SC2=CC=CC=N2

InChI

InChI=1S/C13H16N2S/c14-10-12(11-6-2-1-3-7-11)16-13-8-4-5-9-15-13/h4-5,8-9,11-12H,1-3,6-7H2