3-[(6-phenylazanyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)amino]benzenecarbonitrile

Systemtic Name: 3-[(6-phenylazanyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)amino]benzenecarbonitrile Openeye Name: 3-[(6-anilino-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)amino]benzonitrile CAS Name: 3-[(6-anilino-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)amino]benzonitrile IUPAC Name: 3-[(6-anilino-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)amino]benzonitrile Traditional Name: 3-[(6-anilino-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)amino]benzonitrile Formula: C18H13N7 MolecularWeight: 327.34272

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NN3C(=NN=C3NC4=CC=CC(=C4)C#N)C=C2

Isomeric SMILES

C1=CC=C(C=C1)NC2=NN3C(=NN=C3NC4=CC=CC(=C4)C#N)C=C2

InChI

InChI=1S/C18H13N7/c19-12-13-5-4-8-15(11-13)21-18-23-22-17-10-9-16(24-25(17)18)20-14-6-2-1-3-7-14/h1-11H,(H,20,24)(H,21,23)