4-[1-chloranyl-5-[2-(4-propylcyclohexyl)ethyl]-2H-pyrimidin-2-yl]benzenecarbonitrile

Systemtic Name: 4-[1-chloranyl-5-[2-(4-propylcyclohexyl)ethyl]-2H-pyrimidin-2-yl]benzenecarbonitrile Openeye Name: 4-[1-chloro-5-[2-(4-propylcyclohexyl)ethyl]-2H-pyrimidin-2-yl]benzonitrile CAS Name: 4-[1-chloro-5-[2-(4-propylcyclohexyl)ethyl]-2H-pyrimidin-2-yl]benzonitrile IUPAC Name: 4-[1-chloro-5-[2-(4-propylcyclohexyl)ethyl]-2H-pyrimidin-2-yl]benzonitrile Traditional Name: 4-[1-chloro-5-[2-(4-propylcyclohexyl)ethyl]-2H-pyrimidin-2-yl]benzonitrile Formula: C22H28ClN3 MolecularWeight: 369.93082

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC(CC1)CCC2=CN(C(N=C2)C3=CC=C(C=C3)C#N)Cl

Isomeric SMILES

CCCC1CCC(CC1)CCC2=CN(C(N=C2)C3=CC=C(C=C3)C#N)Cl

InChI

InChI=1S/C22H28ClN3/c1-2-3-17-4-6-18(7-5-17)8-9-20-15-25-22(26(23)16-20)21-12-10-19(14-24)11-13-21/h10-13,15-18,22H,2-9H2,1H3