2-fluoranyl-4-[5-(4-heptylcyclohexyl)pyrimidin-2-yl]benzenecarbonitrile

Systemtic Name: 2-fluoranyl-4-[5-(4-heptylcyclohexyl)pyrimidin-2-yl]benzenecarbonitrile Openeye Name: 2-fluoro-4-[5-(4-heptylcyclohexyl)pyrimidin-2-yl]benzonitrile CAS Name: 2-fluoro-4-[5-(4-heptylcyclohexyl)-2-pyrimidinyl]benzonitrile IUPAC Name: 2-fluoro-4-[5-(4-heptylcyclohexyl)pyrimidin-2-yl]benzonitrile Traditional Name: 2-fluoro-4-[5-(4-heptylcyclohexyl)pyrimidin-2-yl]benzonitrile Formula: C24H30FN3 MolecularWeight: 379.513503

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C2=CN=C(N=C2)C3=CC(=C(C=C3)C#N)F

Isomeric SMILES

CCCCCCCC1CCC(CC1)C2=CN=C(N=C2)C3=CC(=C(C=C3)C#N)F

InChI

InChI=1S/C24H30FN3/c1-2-3-4-5-6-7-18-8-10-19(11-9-18)22-16-27-24(28-17-22)20-12-13-21(15-26)23(25)14-20/h12-14,16-19H,2-11H2,1H3