3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]carbonyl-6-methyl-1-[2-(trifluoromethyl)phenyl]pyridazin-4-one

Systemtic Name: 3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]carbonyl-6-methyl-1-[2-(trifluoromethyl)phenyl]pyridazin-4-one Openeye Name: 3-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-6-methyl-1-[2-(trifluoromethyl)phenyl]pyridazin-4-one CAS Name: 3-[[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-oxomethyl]-6-methyl-1-[2-(trifluoromethyl)phenyl]-4-pyridazinone IUPAC Name: 3-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-6-methyl-1-[2-(trifluoromethyl)phenyl]pyridazin-4-one Traditional Name: 3-[4-(2-furoyl)piperazine-1-carbonyl]-6-methyl-1-[2-(trifluoromethyl)phenyl]pyridazin-4-one Formula: C22H19F3N4O4 MolecularWeight: 460.40587

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2C(F)(F)F)C(=O)N3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2C(F)(F)F)C(=O)N3CCN(CC3)C(=O)C4=CC=CO4

InChI

InChI=1S/C22H19F3N4O4/c1-14-13-17(30)19(26-29(14)16-6-3-2-5-15(16)22(23,24)25)21(32)28-10-8-27(9-11-28)20(31)18-7-4-12-33-18/h2-7,12-13H,8-11H2,1H3