4-[1-(4-fluorophenyl)-5-(2-methyl-3-oxidanyl-propoxy)-6-oxidanylidene-pyridazin-4-yl]benzenesulfonamide

Systemtic Name: 4-[1-(4-fluorophenyl)-5-(2-methyl-3-oxidanyl-propoxy)-6-oxidanylidene-pyridazin-4-yl]benzenesulfonamide Openeye Name: 4-[1-(4-fluorophenyl)-5-(3-hydroxy-2-methyl-propoxy)-6-oxo-pyridazin-4-yl]benzenesulfonamide CAS Name: 4-[1-(4-fluorophenyl)-5-(3-hydroxy-2-methylpropoxy)-6-oxo-4-pyridazinyl]benzenesulfonamide IUPAC Name: 4-[1-(4-fluorophenyl)-5-(3-hydroxy-2-methylpropoxy)-6-oxopyridazin-4-yl]benzenesulfonamide Traditional Name: 4-[1-(4-fluorophenyl)-5-(3-hydroxy-2-methyl-propoxy)-6-keto-pyridazin-4-yl]benzenesulfonamide Formula: C20H20FN3O5S MolecularWeight: 433.453303

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)COC1=C(C=NN(C1=O)C2=CC=C(C=C2)F)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC(CO)COC1=C(C=NN(C1=O)C2=CC=C(C=C2)F)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C20H20FN3O5S/c1-13(11-25)12-29-19-18(14-2-8-17(9-3-14)30(22,27)28)10-23-24(20(19)26)16-6-4-15(21)5-7-16/h2-10,13,25H,11-12H2,1H3,(H2,22,27,28)