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

Systemtic Name: 4-[5-[2-(4-butylcyclohexyl)ethyl]pyrimidin-2-yl]benzenecarbonitrile Openeye Name: 4-[5-[2-(4-butylcyclohexyl)ethyl]pyrimidin-2-yl]benzonitrile CAS Name: 4-[5-[2-(4-butylcyclohexyl)ethyl]-2-pyrimidinyl]benzonitrile IUPAC Name: 4-[5-[2-(4-butylcyclohexyl)ethyl]pyrimidin-2-yl]benzonitrile Traditional Name: 4-[5-[2-(4-butylcyclohexyl)ethyl]pyrimidin-2-yl]benzonitrile Formula: C23H29N3 MolecularWeight: 347.49646

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3/c1-2-3-4-18-5-7-19(8-6-18)9-10-21-16-25-23(26-17-21)22-13-11-20(15-24)12-14-22/h11-14,16-19H,2-10H2,1H3