3-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]carbonyl-1-(2-fluorophenyl)-6-methyl-pyridazin-4-one

Systemtic Name: 3-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]carbonyl-1-(2-fluorophenyl)-6-methyl-pyridazin-4-one Openeye Name: 3-[4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazine-1-carbonyl]-1-(2-fluorophenyl)-6-methyl-pyridazin-4-one CAS Name: 3-[[4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazinyl]-oxomethyl]-1-(2-fluorophenyl)-6-methyl-4-pyridazinone IUPAC Name: 3-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazine-1-carbonyl]-1-(2-fluorophenyl)-6-methylpyridazin-4-one Traditional Name: 3-[4-(coumaran-5-ylmethyl)piperazine-1-carbonyl]-1-(2-fluorophenyl)-6-methyl-pyridazin-4-one Formula: C25H25FN4O3 MolecularWeight: 448.489403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2F)C(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCC5

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2F)C(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCC5

InChI

InChI=1S/C25H25FN4O3/c1-17-14-22(31)24(27-30(17)21-5-3-2-4-20(21)26)25(32)29-11-9-28(10-12-29)16-18-6-7-23-19(15-18)8-13-33-23/h2-7,14-15H,8-13,16H2,1H3