2-[5-(1-methylpyrazol-4-yl)-2-oxidanylidene-1-phenyl-pyridin-3-yl]benzenecarbonitrile

Systemtic Name: 2-[5-(1-methylpyrazol-4-yl)-2-oxidanylidene-1-phenyl-pyridin-3-yl]benzenecarbonitrile Openeye Name: 2-[5-(1-methylpyrazol-4-yl)-2-oxo-1-phenyl-3-pyridyl]benzonitrile CAS Name: 2-[5-(1-methyl-4-pyrazolyl)-2-oxo-1-phenyl-3-pyridinyl]benzonitrile IUPAC Name: 2-[5-(1-methylpyrazol-4-yl)-2-oxo-1-phenylpyridin-3-yl]benzonitrile Traditional Name: 2-[2-keto-5-(1-methylpyrazol-4-yl)-1-phenyl-3-pyridyl]benzonitrile Formula: C22H16N4O MolecularWeight: 352.38864

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2=CN(C(=O)C(=C2)C3=CC=CC=C3C#N)C4=CC=CC=C4

Isomeric SMILES

CN1C=C(C=N1)C2=CN(C(=O)C(=C2)C3=CC=CC=C3C#N)C4=CC=CC=C4

InChI

InChI=1S/C22H16N4O/c1-25-14-18(13-24-25)17-11-21(20-10-6-5-7-16(20)12-23)22(27)26(15-17)19-8-3-2-4-9-19/h2-11,13-15H,1H3