2,6-bis(fluoranyl)-4-[5-(4-hexylcyclohexyl)pyrimidin-2-yl]benzenecarbonitrile

Systemtic Name: 2,6-bis(fluoranyl)-4-[5-(4-hexylcyclohexyl)pyrimidin-2-yl]benzenecarbonitrile Openeye Name: 2,6-difluoro-4-[5-(4-hexylcyclohexyl)pyrimidin-2-yl]benzonitrile CAS Name: 2,6-difluoro-4-[5-(4-hexylcyclohexyl)-2-pyrimidinyl]benzonitrile IUPAC Name: 2,6-difluoro-4-[5-(4-hexylcyclohexyl)pyrimidin-2-yl]benzonitrile Traditional Name: 2,6-difluoro-4-[5-(4-hexylcyclohexyl)pyrimidin-2-yl]benzonitrile Formula: C23H27F2N3 MolecularWeight: 383.477386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(CC1)C2=CN=C(N=C2)C3=CC(=C(C(=C3)F)C#N)F

Isomeric SMILES

CCCCCCC1CCC(CC1)C2=CN=C(N=C2)C3=CC(=C(C(=C3)F)C#N)F

InChI

InChI=1S/C23H27F2N3/c1-2-3-4-5-6-16-7-9-17(10-8-16)19-14-27-23(28-15-19)18-11-21(24)20(13-26)22(25)12-18/h11-12,14-17H,2-10H2,1H3