[6-(1-benzofuran-5-yl)-2-[(4-fluorophenyl)methyl]-3-oxidanylidene-pyridazin-4-yl]methyl methanesulfonate

Systemtic Name: [6-(1-benzofuran-5-yl)-2-[(4-fluorophenyl)methyl]-3-oxidanylidene-pyridazin-4-yl]methyl methanesulfonate Openeye Name: [6-(benzofuran-5-yl)-2-[(4-fluorophenyl)methyl]-3-oxo-pyridazin-4-yl]methyl methanesulfonate CAS Name: methanesulfonic acid [6-(5-benzofuranyl)-2-[(4-fluorophenyl)methyl]-3-oxo-4-pyridazinyl]methyl ester IUPAC Name: [6-(1-benzofuran-5-yl)-2-[(4-fluorophenyl)methyl]-3-oxopyridazin-4-yl]methyl methanesulfonate Traditional Name: methanesulfonic acid [6-(benzofuran-5-yl)-2-(4-fluorobenzyl)-3-keto-pyridazin-4-yl]methyl ester Formula: C21H17FN2O5S MolecularWeight: 428.433483

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCC1=CC(=NN(C1=O)CC2=CC=C(C=C2)F)C3=CC4=C(C=C3)OC=C4

Isomeric SMILES

CS(=O)(=O)OCC1=CC(=NN(C1=O)CC2=CC=C(C=C2)F)C3=CC4=C(C=C3)OC=C4

InChI

InChI=1S/C21H17FN2O5S/c1-30(26,27)29-13-17-11-19(15-4-7-20-16(10-15)8-9-28-20)23-24(21(17)25)12-14-2-5-18(22)6-3-14/h2-11H,12-13H2,1H3