4-[5-[2-(4-butylcyclohexyl)ethyl]pyrimidin-2-yl]-2-methyl-benzenecarbonitrile

Systemtic Name: 4-[5-[2-(4-butylcyclohexyl)ethyl]pyrimidin-2-yl]-2-methyl-benzenecarbonitrile Openeye Name: 4-[5-[2-(4-butylcyclohexyl)ethyl]pyrimidin-2-yl]-2-methyl-benzonitrile CAS Name: 4-[5-[2-(4-butylcyclohexyl)ethyl]-2-pyrimidinyl]-2-methylbenzonitrile IUPAC Name: 4-[5-[2-(4-butylcyclohexyl)ethyl]pyrimidin-2-yl]-2-methylbenzonitrile Traditional Name: 4-[5-[2-(4-butylcyclohexyl)ethyl]pyrimidin-2-yl]-2-methyl-benzonitrile Formula: C24H31N3 MolecularWeight: 361.52304

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)CCC2=CN=C(N=C2)C3=CC(=C(C=C3)C#N)C

Isomeric SMILES

CCCCC1CCC(CC1)CCC2=CN=C(N=C2)C3=CC(=C(C=C3)C#N)C

InChI

InChI=1S/C24H31N3/c1-3-4-5-19-6-8-20(9-7-19)10-11-21-16-26-24(27-17-21)22-12-13-23(15-25)18(2)14-22/h12-14,16-17,19-20H,3-11H2,1-2H3