3-[6-chloranyl-2-fluoranyl-3-(2H-pyrazolo[3,4-c]pyridazin-3-ylmethyl)phenoxy]-5-methyl-benzenecarbonitrile

Systemtic Name: 3-[6-chloranyl-2-fluoranyl-3-(2H-pyrazolo[3,4-c]pyridazin-3-ylmethyl)phenoxy]-5-methyl-benzenecarbonitrile Openeye Name: 3-[6-chloro-2-fluoro-3-(2H-pyrazolo[3,4-c]pyridazin-3-ylmethyl)phenoxy]-5-methyl-benzonitrile CAS Name: 3-[6-chloro-2-fluoro-3-(2H-pyrazolo[3,4-c]pyridazin-3-ylmethyl)phenoxy]-5-methylbenzonitrile IUPAC Name: 3-[6-chloro-2-fluoro-3-(2H-pyrazolo[3,4-c]pyridazin-3-ylmethyl)phenoxy]-5-methylbenzonitrile Traditional Name: 3-[6-chloro-2-fluoro-3-(2H-pyrazolo[3,4-c]pyridazin-3-ylmethyl)phenoxy]-5-methyl-benzonitrile Formula: C20H13ClFN5O MolecularWeight: 393.801523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C#N)OC2=C(C=CC(=C2F)CC3=C4C=CN=NC4=NN3)Cl

Isomeric SMILES

CC1=CC(=CC(=C1)C#N)OC2=C(C=CC(=C2F)CC3=C4C=CN=NC4=NN3)Cl

InChI

InChI=1S/C20H13ClFN5O/c1-11-6-12(10-23)8-14(7-11)28-19-16(21)3-2-13(18(19)22)9-17-15-4-5-24-26-20(15)27-25-17/h2-8H,9H2,1H3,(H,25,26,27)