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

Systemtic Name: 3-[3-azanyl-5-(3-chlorophenyl)-2H-pyrazolo[3,4-c]pyridazin-4-yl]benzenecarbonitrile Openeye Name: 3-[3-amino-5-(3-chlorophenyl)-2H-pyrazolo[3,4-c]pyridazin-4-yl]benzonitrile CAS Name: 3-[3-amino-5-(3-chlorophenyl)-2H-pyrazolo[3,4-c]pyridazin-4-yl]benzonitrile IUPAC Name: 3-[3-amino-5-(3-chlorophenyl)-2H-pyrazolo[3,4-c]pyridazin-4-yl]benzonitrile Traditional Name: 3-[3-amino-5-(3-chlorophenyl)-2H-pyrazolo[3,4-c]pyridazin-4-yl]benzonitrile Formula: C18H11ClN6 MolecularWeight: 346.77314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H11ClN6/c19-13-6-2-5-12(8-13)16-14(11-4-1-3-10(7-11)9-20)15-17(21)23-25-18(15)24-22-16/h1-8H,(H3,21,23,24,25)