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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NN(C2=O)C3=CC=CC=C3C#N)C4=NC=CN=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NN(C2=O)C3=CC=CC=C3C#N)C4=NC=CN=C4

InChI

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