1-[3-(6-oxidanylidene-3-pyridin-4-yl-pyridazin-1-yl)propyl]-3-[4-(trifluoromethyl)phenyl]urea

Systemtic Name: 1-[3-(6-oxidanylidene-3-pyridin-4-yl-pyridazin-1-yl)propyl]-3-[4-(trifluoromethyl)phenyl]urea Openeye Name: 1-[3-[6-oxo-3-(4-pyridyl)pyridazin-1-yl]propyl]-3-[4-(trifluoromethyl)phenyl]urea CAS Name: 1-[3-(6-oxo-3-pyridin-4-yl-1-pyridazinyl)propyl]-3-[4-(trifluoromethyl)phenyl]urea IUPAC Name: 1-[3-(6-oxo-3-pyridin-4-ylpyridazin-1-yl)propyl]-3-[4-(trifluoromethyl)phenyl]urea Traditional Name: 1-[3-[6-keto-3-(4-pyridyl)pyridazin-1-yl]propyl]-3-[4-(trifluoromethyl)phenyl]urea Formula: C20H18F3N5O2 MolecularWeight: 417.38443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(F)(F)F)NC(=O)NCCCN2C(=O)C=CC(=N2)C3=CC=NC=C3

Isomeric SMILES

C1=CC(=CC=C1C(F)(F)F)NC(=O)NCCCN2C(=O)C=CC(=N2)C3=CC=NC=C3

InChI

InChI=1S/C20H18F3N5O2/c21-20(22,23)15-2-4-16(5-3-15)26-19(30)25-10-1-13-28-18(29)7-6-17(27-28)14-8-11-24-12-9-14/h2-9,11-12H,1,10,13H2,(H2,25,26,30)