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

Systemtic Name: 4-[1-(3-chlorophenyl)-5-(3-methyl-4-oxidanyl-butoxy)-6-oxidanylidene-pyridazin-4-yl]benzenesulfonamide Openeye Name: 4-[1-(3-chlorophenyl)-5-(4-hydroxy-3-methyl-butoxy)-6-oxo-pyridazin-4-yl]benzenesulfonamide CAS Name: 4-[1-(3-chlorophenyl)-5-(4-hydroxy-3-methylbutoxy)-6-oxo-4-pyridazinyl]benzenesulfonamide IUPAC Name: 4-[1-(3-chlorophenyl)-5-(4-hydroxy-3-methylbutoxy)-6-oxopyridazin-4-yl]benzenesulfonamide Traditional Name: 4-[1-(3-chlorophenyl)-5-(4-hydroxy-3-methyl-butoxy)-6-keto-pyridazin-4-yl]benzenesulfonamide Formula: C21H22ClN3O5S MolecularWeight: 463.93448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCOC1=C(C=NN(C1=O)C2=CC(=CC=C2)Cl)C3=CC=C(C=C3)S(=O)(=O)N)CO

Isomeric SMILES

CC(CCOC1=C(C=NN(C1=O)C2=CC(=CC=C2)Cl)C3=CC=C(C=C3)S(=O)(=O)N)CO

InChI

InChI=1S/C21H22ClN3O5S/c1-14(13-26)9-10-30-20-19(15-5-7-18(8-6-15)31(23,28)29)12-24-25(21(20)27)17-4-2-3-16(22)11-17/h2-8,11-12,14,26H,9-10,13H2,1H3,(H2,23,28,29)