[6-(3-fluoranyl-4-methoxy-phenyl)-5-methyl-2-(2-methylpropyl)-3-oxidanylidene-pyridazin-4-yl] methanesulfonate

Systemtic Name: [6-(3-fluoranyl-4-methoxy-phenyl)-5-methyl-2-(2-methylpropyl)-3-oxidanylidene-pyridazin-4-yl] methanesulfonate Openeye Name: [6-(3-fluoro-4-methoxy-phenyl)-2-isobutyl-5-methyl-3-oxo-pyridazin-4-yl] methanesulfonate CAS Name: methanesulfonic acid [6-(3-fluoro-4-methoxyphenyl)-5-methyl-2-(2-methylpropyl)-3-oxo-4-pyridazinyl] ester IUPAC Name: [6-(3-fluoro-4-methoxyphenyl)-5-methyl-2-(2-methylpropyl)-3-oxopyridazin-4-yl] methanesulfonate Traditional Name: methanesulfonic acid [6-(3-fluoro-4-methoxy-phenyl)-2-isobutyl-3-keto-5-methyl-pyridazin-4-yl] ester Formula: C17H21FN2O5S MolecularWeight: 384.422443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C2=CC(=C(C=C2)OC)F)CC(C)C)OS(=O)(=O)C

Isomeric SMILES

CC1=C(C(=O)N(N=C1C2=CC(=C(C=C2)OC)F)CC(C)C)OS(=O)(=O)C

InChI

InChI=1S/C17H21FN2O5S/c1-10(2)9-20-17(21)16(25-26(5,22)23)11(3)15(19-20)12-6-7-14(24-4)13(18)8-12/h6-8,10H,9H2,1-5H3