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

Systemtic Name: N-[4-[1-(3-chloranyl-4-fluoranyl-phenyl)-5-(2-methyl-2-oxidanyl-propoxy)-6-oxidanylidene-pyridazin-4-yl]phenyl]sulfonylethanamide Openeye Name: N-[4-[1-(3-chloro-4-fluoro-phenyl)-5-(2-hydroxy-2-methyl-propoxy)-6-oxo-pyridazin-4-yl]phenyl]sulfonylacetamide CAS Name: N-[4-[1-(3-chloro-4-fluorophenyl)-5-(2-hydroxy-2-methylpropoxy)-6-oxo-4-pyridazinyl]phenyl]sulfonylacetamide IUPAC Name: N-[4-[1-(3-chloro-4-fluorophenyl)-5-(2-hydroxy-2-methylpropoxy)-6-oxopyridazin-4-yl]phenyl]sulfonylacetamide Traditional Name: N-[4-[1-(3-chloro-4-fluoro-phenyl)-5-(2-hydroxy-2-methyl-propoxy)-6-keto-pyridazin-4-yl]phenyl]sulfonylacetamide Formula: C22H21ClFN3O6S MolecularWeight: 509.935043

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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(=C(C=C3)F)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(=C(C=C3)F)Cl)OCC(C)(C)O

InChI

InChI=1S/C22H21ClFN3O6S/c1-13(28)26-34(31,32)16-7-4-14(5-8-16)17-11-25-27(15-6-9-19(24)18(23)10-15)21(29)20(17)33-12-22(2,3)30/h4-11,30H,12H2,1-3H3,(H,26,28)