2-[[3-[3-(1-methylpyrazol-4-yl)phenyl]pyrazol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 2-[[3-[3-(1-methylpyrazol-4-yl)phenyl]pyrazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 2-[[3-[3-(1-methylpyrazol-4-yl)phenyl]pyrazol-1-yl]methyl]benzonitrile CAS Name: 2-[[3-[3-(1-methyl-4-pyrazolyl)phenyl]-1-pyrazolyl]methyl]benzonitrile IUPAC Name: 2-[[3-[3-(1-methylpyrazol-4-yl)phenyl]pyrazol-1-yl]methyl]benzonitrile Traditional Name: 2-[[3-[3-(1-methylpyrazol-4-yl)phenyl]pyrazol-1-yl]methyl]benzonitrile Formula: C21H17N5 MolecularWeight: 339.39318

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2=CC(=CC=C2)C3=NN(C=C3)CC4=CC=CC=C4C#N

Isomeric SMILES

CN1C=C(C=N1)C2=CC(=CC=C2)C3=NN(C=C3)CC4=CC=CC=C4C#N

InChI

InChI=1S/C21H17N5/c1-25-14-20(13-23-25)16-7-4-8-17(11-16)21-9-10-26(24-21)15-19-6-3-2-5-18(19)12-22/h2-11,13-14H,15H2,1H3