3-[[3-(3-pyrimidin-2-ylphenyl)pyrazol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 3-[[3-(3-pyrimidin-2-ylphenyl)pyrazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 3-[[3-(3-pyrimidin-2-ylphenyl)pyrazol-1-yl]methyl]benzonitrile CAS Name: 3-[[3-[3-(2-pyrimidinyl)phenyl]-1-pyrazolyl]methyl]benzonitrile IUPAC Name: 3-[[3-(3-pyrimidin-2-ylphenyl)pyrazol-1-yl]methyl]benzonitrile Traditional Name: 3-[[3-[3-(2-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=NC=CC=N4)C#N

Isomeric SMILES

C1=CC(=CC(=C1)CN2C=CC(=N2)C3=CC(=CC=C3)C4=NC=CC=N4)C#N

InChI

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