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

Systemtic Name: N-[4-[1-(3-chlorophenyl)-5-(2-methyl-2-oxidanyl-propoxy)-6-oxidanylidene-pyridazin-4-yl]phenyl]sulfonylethanamide Openeye Name: N-[4-[1-(3-chlorophenyl)-5-(2-hydroxy-2-methyl-propoxy)-6-oxo-pyridazin-4-yl]phenyl]sulfonylacetamide CAS Name: N-[4-[1-(3-chlorophenyl)-5-(2-hydroxy-2-methylpropoxy)-6-oxo-4-pyridazinyl]phenyl]sulfonylacetamide IUPAC Name: N-[4-[1-(3-chlorophenyl)-5-(2-hydroxy-2-methylpropoxy)-6-oxopyridazin-4-yl]phenyl]sulfonylacetamide Traditional Name: N-[4-[1-(3-chlorophenyl)-5-(2-hydroxy-2-methyl-propoxy)-6-keto-pyridazin-4-yl]phenyl]sulfonylacetamide Formula: C22H22ClN3O6S MolecularWeight: 491.94458

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)N(N=C2)C3=CC(=CC=C3)Cl)OCC(C)(C)O

Isomeric SMILES

CC(=O)NS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)N(N=C2)C3=CC(=CC=C3)Cl)OCC(C)(C)O

InChI

InChI=1S/C22H22ClN3O6S/c1-14(27)25-33(30,31)18-9-7-15(8-10-18)19-12-24-26(17-6-4-5-16(23)11-17)21(28)20(19)32-13-22(2,3)29/h4-12,29H,13H2,1-3H3,(H,25,27)