2-(3-azanyl-4-phenyl-2H-pyrazolo[3,4-c]pyridazin-5-yl)benzenecarbonitrile

Systemtic Name: 2-(3-azanyl-4-phenyl-2H-pyrazolo[3,4-c]pyridazin-5-yl)benzenecarbonitrile Openeye Name: 2-(3-amino-4-phenyl-2H-pyrazolo[3,4-c]pyridazin-5-yl)benzonitrile CAS Name: 2-(3-amino-4-phenyl-2H-pyrazolo[3,4-c]pyridazin-5-yl)benzonitrile IUPAC Name: 2-(3-amino-4-phenyl-2H-pyrazolo[3,4-c]pyridazin-5-yl)benzonitrile Traditional Name: 2-(3-amino-4-phenyl-2H-pyrazolo[3,4-c]pyridazin-5-yl)benzonitrile Formula: C18H12N6 MolecularWeight: 312.32808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=NC3=NNC(=C23)N)C4=CC=CC=C4C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=NC3=NNC(=C23)N)C4=CC=CC=C4C#N

InChI

InChI=1S/C18H12N6/c19-10-12-8-4-5-9-13(12)16-14(11-6-2-1-3-7-11)15-17(20)22-24-18(15)23-21-16/h1-9H,(H3,20,22,23,24)