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

Systemtic Name: 3-[4-(furan-3-ylcarbonyl)piperazin-1-yl]carbonyl-6-methyl-1-[3-(trifluoromethyl)phenyl]pyridazin-4-one Openeye Name: 3-[4-(furan-3-carbonyl)piperazine-1-carbonyl]-6-methyl-1-[3-(trifluoromethyl)phenyl]pyridazin-4-one CAS Name: 3-[[4-[3-furanyl(oxo)methyl]-1-piperazinyl]-oxomethyl]-6-methyl-1-[3-(trifluoromethyl)phenyl]-4-pyridazinone IUPAC Name: 3-[4-(furan-3-carbonyl)piperazine-1-carbonyl]-6-methyl-1-[3-(trifluoromethyl)phenyl]pyridazin-4-one Traditional Name: 3-[4-(3-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=COC=C4

Isomeric SMILES

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

InChI

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