N-[3-[6-(2-methylpropoxy)pyridazin-3-yl]phenyl]-3-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[3-[6-(2-methylpropoxy)pyridazin-3-yl]phenyl]-3-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[3-(6-isobutoxypyridazin-3-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide CAS Name: N-[3-[6-(2-methylpropoxy)-3-pyridazinyl]phenyl]-3-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[3-[6-(2-methylpropoxy)pyridazin-3-yl]phenyl]-3-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[3-(6-isobutoxypyridazin-3-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide Formula: C21H20F3N3O3S MolecularWeight: 451.46201

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=NN=C(C=C1)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC(C)COC1=NN=C(C=C1)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C21H20F3N3O3S/c1-14(2)13-30-20-10-9-19(25-26-20)15-5-3-7-17(11-15)27-31(28,29)18-8-4-6-16(12-18)21(22,23)24/h3-12,14,27H,13H2,1-2H3