4-[4-(2-methylpyrimidin-5-yl)phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-(2-methylpyrimidin-5-yl)phenyl]benzenecarbonitrile Openeye Name: 4-[4-(2-methylpyrimidin-5-yl)phenyl]benzonitrile CAS Name: 4-[4-(2-methyl-5-pyrimidinyl)phenyl]benzonitrile IUPAC Name: 4-[4-(2-methylpyrimidin-5-yl)phenyl]benzonitrile Traditional Name: 4-[4-(2-methylpyrimidin-5-yl)phenyl]benzonitrile Formula: C18H13N3 MolecularWeight: 271.31592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=N1)C2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=NC=C(C=N1)C2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

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