methyl 5-[[3-[4-(4-fluorophenyl)piperazin-1-yl]-6-oxidanylidene-pyridazin-1-yl]methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[3-[4-(4-fluorophenyl)piperazin-1-yl]-6-oxidanylidene-pyridazin-1-yl]methyl]furan-2-carboxylate Openeye Name: methyl 5-[[3-[4-(4-fluorophenyl)piperazin-1-yl]-6-oxo-pyridazin-1-yl]methyl]furan-2-carboxylate CAS Name: 5-[[3-[4-(4-fluorophenyl)-1-piperazinyl]-6-oxo-1-pyridazinyl]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[3-[4-(4-fluorophenyl)piperazin-1-yl]-6-oxopyridazin-1-yl]methyl]furan-2-carboxylate Traditional Name: 5-[[3-[4-(4-fluorophenyl)piperazino]-6-keto-pyridazin-1-yl]methyl]furan-2-carboxylic acid methyl ester Formula: C21H21FN4O4 MolecularWeight: 412.414243

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)CN2C(=O)C=CC(=N2)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

COC(=O)C1=CC=C(O1)CN2C(=O)C=CC(=N2)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H21FN4O4/c1-29-21(28)18-7-6-17(30-18)14-26-20(27)9-8-19(23-26)25-12-10-24(11-13-25)16-4-2-15(22)3-5-16/h2-9H,10-14H2,1H3