3-[4-(1-benzofuran-2-ylcarbonyl)piperazin-1-yl]carbonyl-1-(2-fluorophenyl)-6-methyl-pyridazin-4-one

Systemtic Name: 3-[4-(1-benzofuran-2-ylcarbonyl)piperazin-1-yl]carbonyl-1-(2-fluorophenyl)-6-methyl-pyridazin-4-one Openeye Name: 3-[4-(benzofuran-2-carbonyl)piperazine-1-carbonyl]-1-(2-fluorophenyl)-6-methyl-pyridazin-4-one CAS Name: 3-[[4-[2-benzofuranyl(oxo)methyl]-1-piperazinyl]-oxomethyl]-1-(2-fluorophenyl)-6-methyl-4-pyridazinone IUPAC Name: 3-[4-(1-benzofuran-2-carbonyl)piperazine-1-carbonyl]-1-(2-fluorophenyl)-6-methylpyridazin-4-one Traditional Name: 3-[4-(benzofuran-2-carbonyl)piperazine-1-carbonyl]-1-(2-fluorophenyl)-6-methyl-pyridazin-4-one Formula: C25H21FN4O4 MolecularWeight: 460.457043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2F)C(=O)N3CCN(CC3)C(=O)C4=CC5=CC=CC=C5O4

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2F)C(=O)N3CCN(CC3)C(=O)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C25H21FN4O4/c1-16-14-20(31)23(27-30(16)19-8-4-3-7-18(19)26)25(33)29-12-10-28(11-13-29)24(32)22-15-17-6-2-5-9-21(17)34-22/h2-9,14-15H,10-13H2,1H3