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

Systemtic Name: 2-fluoranyl-4-[5-(4-hexylphenyl)pyrimidin-2-yl]benzenecarbonitrile Openeye Name: 2-fluoro-4-[5-(4-hexylphenyl)pyrimidin-2-yl]benzonitrile CAS Name: 2-fluoro-4-[5-(4-hexylphenyl)-2-pyrimidinyl]benzonitrile IUPAC Name: 2-fluoro-4-[5-(4-hexylphenyl)pyrimidin-2-yl]benzonitrile Traditional Name: 2-fluoro-4-[5-(4-hexylphenyl)pyrimidin-2-yl]benzonitrile Formula: C23H22FN3 MolecularWeight: 359.439283

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=CN=C(N=C2)C3=CC(=C(C=C3)C#N)F

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=CN=C(N=C2)C3=CC(=C(C=C3)C#N)F

InChI

InChI=1S/C23H22FN3/c1-2-3-4-5-6-17-7-9-18(10-8-17)21-15-26-23(27-16-21)19-11-12-20(14-25)22(24)13-19/h7-13,15-16H,2-6H2,1H3