4-(7-methyl-3-oxidanylidene-2H-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)benzenecarbonitrile

Systemtic Name: 4-(7-methyl-3-oxidanylidene-2H-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)benzenecarbonitrile Openeye Name: 4-(7-methyl-3-oxo-2H-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)benzonitrile CAS Name: 4-(7-methyl-3-oxo-2H-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)benzonitrile IUPAC Name: 4-(7-methyl-3-oxo-2H-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)benzonitrile Traditional Name: 4-(3-keto-7-methyl-2H-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)benzonitrile Formula: C13H9N5O MolecularWeight: 251.24346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NNC(=O)N2N=C1C3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=CC2=NNC(=O)N2N=C1C3=CC=C(C=C3)C#N

InChI

InChI=1S/C13H9N5O/c1-8-6-11-15-16-13(19)18(11)17-12(8)10-4-2-9(7-14)3-5-10/h2-6H,1H3,(H,16,19)