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

Systemtic Name: 3-[4-(4-ethanoylphenyl)piperazin-1-yl]carbonyl-6-methyl-1-[2-(trifluoromethyl)phenyl]pyridazin-4-one Openeye Name: 3-[4-(4-acetylphenyl)piperazine-1-carbonyl]-6-methyl-1-[2-(trifluoromethyl)phenyl]pyridazin-4-one CAS Name: 3-[[4-(4-acetylphenyl)-1-piperazinyl]-oxomethyl]-6-methyl-1-[2-(trifluoromethyl)phenyl]-4-pyridazinone IUPAC Name: 3-[4-(4-acetylphenyl)piperazine-1-carbonyl]-6-methyl-1-[2-(trifluoromethyl)phenyl]pyridazin-4-one Traditional Name: 3-[4-(4-acetylphenyl)piperazine-1-carbonyl]-6-methyl-1-[2-(trifluoromethyl)phenyl]pyridazin-4-one Formula: C25H23F3N4O3 MolecularWeight: 484.47033

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H23F3N4O3/c1-16-15-22(34)23(29-32(16)21-6-4-3-5-20(21)25(26,27)28)24(35)31-13-11-30(12-14-31)19-9-7-18(8-10-19)17(2)33/h3-10,15H,11-14H2,1-2H3