5-(4-heptylcyclohexyl)-2-pyrimidin-2-yl-benzenecarbonitrile

Systemtic Name: 5-(4-heptylcyclohexyl)-2-pyrimidin-2-yl-benzenecarbonitrile Openeye Name: 5-(4-heptylcyclohexyl)-2-pyrimidin-2-yl-benzonitrile CAS Name: 5-(4-heptylcyclohexyl)-2-(2-pyrimidinyl)benzonitrile IUPAC Name: 5-(4-heptylcyclohexyl)-2-pyrimidin-2-ylbenzonitrile Traditional Name: 5-(4-heptylcyclohexyl)-2-(2-pyrimidyl)benzonitrile Formula: C24H31N3 MolecularWeight: 361.52304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C2=CC(=C(C=C2)C3=NC=CC=N3)C#N

Isomeric SMILES

CCCCCCCC1CCC(CC1)C2=CC(=C(C=C2)C3=NC=CC=N3)C#N

InChI

InChI=1S/C24H31N3/c1-2-3-4-5-6-8-19-9-11-20(12-10-19)21-13-14-23(22(17-21)18-25)24-26-15-7-16-27-24/h7,13-17,19-20H,2-6,8-12H2,1H3