5-methyl-2-methylsulfanyl-4-oxidanylidene-1H-pyridazino[1,6-a]benzimidazol-5-ium-3-carbonitrile

Systemtic Name: 5-methyl-2-methylsulfanyl-4-oxidanylidene-1H-pyridazino[1,6-a]benzimidazol-5-ium-3-carbonitrile Openeye Name: 5-methyl-2-methylsulfanyl-4-oxo-1H-pyridazino[1,6-a]benzimidazol-5-ium-3-carbonitrile CAS Name: 5-methyl-2-(methylthio)-4-oxo-1H-pyridazino[1,6-a]benzimidazol-5-ium-3-carbonitrile IUPAC Name: 5-methyl-2-methylsulfanyl-4-oxo-1H-pyridazino[1,6-a]benzimidazol-5-ium-3-carbonitrile Traditional Name: 4-keto-5-methyl-2-(methylthio)-1H-pyridazino[1,6-a]benzimidazol-5-ium-3-carbonitrile Formula: C13H11N4OS+ MolecularWeight: 271.31764

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2C(=O)C(=C(NN2C3=CC=CC=C31)SC)C#N

Isomeric SMILES

C[N+]1=C2C(=O)C(=C(NN2C3=CC=CC=C31)SC)C#N

InChI

InChI=1S/C13H10N4OS/c1-16-9-5-3-4-6-10(9)17-13(16)11(18)8(7-14)12(15-17)19-2/h3-6H,1-2H3/p+1