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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=C(C3=C(NN=C3N=N2)N)C4=CC=C(C=C4)C#N)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C2=C(C3=C(NN=C3N=N2)N)C4=CC=C(C=C4)C#N)Cl

InChI

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