2-(6-oxidanylidene-5-pyridin-2-yl-3-pyridin-3-yl-pyridazin-1-yl)benzenecarbonitrile

Systemtic Name: 2-(6-oxidanylidene-5-pyridin-2-yl-3-pyridin-3-yl-pyridazin-1-yl)benzenecarbonitrile Openeye Name: 2-[6-oxo-5-(2-pyridyl)-3-(3-pyridyl)pyridazin-1-yl]benzonitrile CAS Name: 2-[6-oxo-5-(2-pyridinyl)-3-(3-pyridinyl)-1-pyridazinyl]benzonitrile IUPAC Name: 2-(6-oxo-5-pyridin-2-yl-3-pyridin-3-ylpyridazin-1-yl)benzonitrile Traditional Name: 2-[6-keto-5-(2-pyridyl)-3-(3-pyridyl)pyridazin-1-yl]benzonitrile Formula: C21H13N5O MolecularWeight: 351.36082

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)N2C(=O)C(=CC(=N2)C3=CN=CC=C3)C4=CC=CC=N4

Isomeric SMILES

C1=CC=C(C(=C1)C#N)N2C(=O)C(=CC(=N2)C3=CN=CC=C3)C4=CC=CC=N4

InChI

InChI=1S/C21H13N5O/c22-13-15-6-1-2-9-20(15)26-21(27)17(18-8-3-4-11-24-18)12-19(25-26)16-7-5-10-23-14-16/h1-12,14H