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

Systemtic Name: 4-[1-chloranyl-5-[2-(4-ethylcyclohexyl)ethyl]-2H-pyrimidin-2-yl]benzenecarbonitrile Openeye Name: 4-[1-chloro-5-[2-(4-ethylcyclohexyl)ethyl]-2H-pyrimidin-2-yl]benzonitrile CAS Name: 4-[1-chloro-5-[2-(4-ethylcyclohexyl)ethyl]-2H-pyrimidin-2-yl]benzonitrile IUPAC Name: 4-[1-chloro-5-[2-(4-ethylcyclohexyl)ethyl]-2H-pyrimidin-2-yl]benzonitrile Traditional Name: 4-[1-chloro-5-[2-(4-ethylcyclohexyl)ethyl]-2H-pyrimidin-2-yl]benzonitrile Formula: C21H26ClN3 MolecularWeight: 355.90424

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC(CC1)CCC2=CN(C(N=C2)C3=CC=C(C=C3)C#N)Cl

Isomeric SMILES

CCC1CCC(CC1)CCC2=CN(C(N=C2)C3=CC=C(C=C3)C#N)Cl

InChI

InChI=1S/C21H26ClN3/c1-2-16-3-5-17(6-4-16)7-8-19-14-24-21(25(22)15-19)20-11-9-18(13-23)10-12-20/h9-12,14-17,21H,2-8H2,1H3