2-[4-[2-(4-heptylcyclohexyl)ethyl]phenyl]pyrimidine-5-carbonitrile

Systemtic Name: 2-[4-[2-(4-heptylcyclohexyl)ethyl]phenyl]pyrimidine-5-carbonitrile Openeye Name: 2-[4-[2-(4-heptylcyclohexyl)ethyl]phenyl]pyrimidine-5-carbonitrile CAS Name: 2-[4-[2-(4-heptylcyclohexyl)ethyl]phenyl]-5-pyrimidinecarbonitrile IUPAC Name: 2-[4-[2-(4-heptylcyclohexyl)ethyl]phenyl]pyrimidine-5-carbonitrile Traditional Name: 2-[4-[2-(4-heptylcyclohexyl)ethyl]phenyl]pyrimidine-5-carbonitrile Formula: C26H35N3 MolecularWeight: 389.5762

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)CCC2=CC=C(C=C2)C3=NC=C(C=N3)C#N

Isomeric SMILES

CCCCCCCC1CCC(CC1)CCC2=CC=C(C=C2)C3=NC=C(C=N3)C#N

InChI

InChI=1S/C26H35N3/c1-2-3-4-5-6-7-21-8-10-22(11-9-21)12-13-23-14-16-25(17-15-23)26-28-19-24(18-27)20-29-26/h14-17,19-22H,2-13H2,1H3