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

Systemtic Name: 4-[1-(3-chlorophenyl)-5-(2-methyl-2-oxidanyl-propoxy)-6-oxidanylidene-pyridazin-4-yl]benzenesulfonamide Openeye Name: 4-[1-(3-chlorophenyl)-5-(2-hydroxy-2-methyl-propoxy)-6-oxo-pyridazin-4-yl]benzenesulfonamide CAS Name: 4-[1-(3-chlorophenyl)-5-(2-hydroxy-2-methylpropoxy)-6-oxo-4-pyridazinyl]benzenesulfonamide IUPAC Name: 4-[1-(3-chlorophenyl)-5-(2-hydroxy-2-methylpropoxy)-6-oxopyridazin-4-yl]benzenesulfonamide Traditional Name: 4-[1-(3-chlorophenyl)-5-(2-hydroxy-2-methyl-propoxy)-6-keto-pyridazin-4-yl]benzenesulfonamide Formula: C20H20ClN3O5S MolecularWeight: 449.9079

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20ClN3O5S/c1-20(2,26)12-29-18-17(13-6-8-16(9-7-13)30(22,27)28)11-23-24(19(18)25)15-5-3-4-14(21)10-15/h3-11,26H,12H2,1-2H3,(H2,22,27,28)