2-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]-6-phenyl-4-(trifluoromethyl)pyridazin-3-one

Systemtic Name: 2-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]-6-phenyl-4-(trifluoromethyl)pyridazin-3-one Openeye Name: 2-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxo-ethyl]-6-phenyl-4-(trifluoromethyl)pyridazin-3-one CAS Name: 2-[2-(2,5-dimethyl-1-propyl-3-pyrrolyl)-2-oxoethyl]-6-phenyl-4-(trifluoromethyl)-3-pyridazinone IUPAC Name: 2-[2-(2,5-dimethyl-1-propylpyrrol-3-yl)-2-oxoethyl]-6-phenyl-4-(trifluoromethyl)pyridazin-3-one Traditional Name: 2-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-keto-ethyl]-6-phenyl-4-(trifluoromethyl)pyridazin-3-one Formula: C22H22F3N3O2 MolecularWeight: 417.42419

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C(=O)CN2C(=O)C(=CC(=N2)C3=CC=CC=C3)C(F)(F)F)C

Isomeric SMILES

CCCN1C(=CC(=C1C)C(=O)CN2C(=O)C(=CC(=N2)C3=CC=CC=C3)C(F)(F)F)C

InChI

InChI=1S/C22H22F3N3O2/c1-4-10-27-14(2)11-17(15(27)3)20(29)13-28-21(30)18(22(23,24)25)12-19(26-28)16-8-6-5-7-9-16/h5-9,11-12H,4,10,13H2,1-3H3