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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)N3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)N3CCN(CC3)C(=O)C4=CC=CO4

InChI

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