5-[6-cyclopropyl-2-fluoranyl-3-(2H-pyrazolo[3,4-c]pyridazin-3-ylmethyl)phenoxy]benzene-1,3-dicarbonitrile

Systemtic Name: 5-[6-cyclopropyl-2-fluoranyl-3-(2H-pyrazolo[3,4-c]pyridazin-3-ylmethyl)phenoxy]benzene-1,3-dicarbonitrile Openeye Name: 5-[6-cyclopropyl-2-fluoro-3-(2H-pyrazolo[3,4-c]pyridazin-3-ylmethyl)phenoxy]benzene-1,3-dicarbonitrile CAS Name: 5-[6-cyclopropyl-2-fluoro-3-(2H-pyrazolo[3,4-c]pyridazin-3-ylmethyl)phenoxy]benzene-1,3-dicarbonitrile IUPAC Name: 5-[6-cyclopropyl-2-fluoro-3-(2H-pyrazolo[3,4-c]pyridazin-3-ylmethyl)phenoxy]benzene-1,3-dicarbonitrile Traditional Name: 5-[6-cyclopropyl-2-fluoro-3-(2H-pyrazolo[3,4-c]pyridazin-3-ylmethyl)phenoxy]isophthalonitrile Formula: C23H15FN6O MolecularWeight: 410.403203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=C(C(=C(C=C2)CC3=C4C=CN=NC4=NN3)F)OC5=CC(=CC(=C5)C#N)C#N

Isomeric SMILES

C1CC1C2=C(C(=C(C=C2)CC3=C4C=CN=NC4=NN3)F)OC5=CC(=CC(=C5)C#N)C#N

InChI

InChI=1S/C23H15FN6O/c24-21-16(10-20-19-5-6-27-29-23(19)30-28-20)3-4-18(15-1-2-15)22(21)31-17-8-13(11-25)7-14(9-17)12-26/h3-9,15H,1-2,10H2,(H,28,29,30)