4-[5-(4-methylphenyl)pyrimidin-2-yl]benzenecarbonitrile

Systemtic Name: 4-[5-(4-methylphenyl)pyrimidin-2-yl]benzenecarbonitrile Openeye Name: 4-[5-(p-tolyl)pyrimidin-2-yl]benzonitrile CAS Name: 4-[5-(4-methylphenyl)-2-pyrimidinyl]benzonitrile IUPAC Name: 4-[5-(4-methylphenyl)pyrimidin-2-yl]benzonitrile Traditional Name: 4-[5-(p-tolyl)pyrimidin-2-yl]benzonitrile Formula: C18H13N3 MolecularWeight: 271.31592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CN=C(N=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=CN=C(N=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H13N3/c1-13-2-6-15(7-3-13)17-11-20-18(21-12-17)16-8-4-14(10-19)5-9-16/h2-9,11-12H,1H3