3-[[3-(3-pyrimidin-5-ylphenyl)pyrazol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 3-[[3-(3-pyrimidin-5-ylphenyl)pyrazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 3-[[3-(3-pyrimidin-5-ylphenyl)pyrazol-1-yl]methyl]benzonitrile CAS Name: 3-[[3-[3-(5-pyrimidinyl)phenyl]-1-pyrazolyl]methyl]benzonitrile IUPAC Name: 3-[[3-(3-pyrimidin-5-ylphenyl)pyrazol-1-yl]methyl]benzonitrile Traditional Name: 3-[[3-[3-(5-pyrimidyl)phenyl]pyrazol-1-yl]methyl]benzonitrile Formula: C21H15N5 MolecularWeight: 337.3773

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CN2C=CC(=N2)C3=CC=CC(=C3)C4=CN=CN=C4)C#N

Isomeric SMILES

C1=CC(=CC(=C1)CN2C=CC(=N2)C3=CC=CC(=C3)C4=CN=CN=C4)C#N

InChI

InChI=1S/C21H15N5/c22-11-16-3-1-4-17(9-16)14-26-8-7-21(25-26)19-6-2-5-18(10-19)20-12-23-15-24-13-20/h1-10,12-13,15H,14H2