3-(6-oxidanylidene-5-phenyl-3-pyrimidin-2-yl-pyridazin-1-yl)pyridine-2-carbonitrile

Systemtic Name: 3-(6-oxidanylidene-5-phenyl-3-pyrimidin-2-yl-pyridazin-1-yl)pyridine-2-carbonitrile Openeye Name: 3-(6-oxo-5-phenyl-3-pyrimidin-2-yl-pyridazin-1-yl)pyridine-2-carbonitrile CAS Name: 3-[6-oxo-5-phenyl-3-(2-pyrimidinyl)-1-pyridazinyl]-2-pyridinecarbonitrile IUPAC Name: 3-(6-oxo-5-phenyl-3-pyrimidin-2-ylpyridazin-1-yl)pyridine-2-carbonitrile Traditional Name: 3-[6-keto-5-phenyl-3-(2-pyrimidyl)pyridazin-1-yl]picolinonitrile Formula: C20H12N6O MolecularWeight: 352.34888

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NN(C2=O)C3=C(N=CC=C3)C#N)C4=NC=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NN(C2=O)C3=C(N=CC=C3)C#N)C4=NC=CC=N4

InChI

InChI=1S/C20H12N6O/c21-13-17-18(8-4-9-22-17)26-20(27)15(14-6-2-1-3-7-14)12-16(25-26)19-23-10-5-11-24-19/h1-12H