2-methyl-N-(1-oxidanylbutan-2-yl)-5-(4-oxidanylidene-3H-phthalazin-1-yl)benzenesulfonamide

Systemtic Name: 2-methyl-N-(1-oxidanylbutan-2-yl)-5-(4-oxidanylidene-3H-phthalazin-1-yl)benzenesulfonamide Openeye Name: N-[1-(hydroxymethyl)propyl]-2-methyl-5-(4-oxo-3H-phthalazin-1-yl)benzenesulfonamide CAS Name: N-(1-hydroxybutan-2-yl)-2-methyl-5-(4-oxo-3H-phthalazin-1-yl)benzenesulfonamide IUPAC Name: N-(1-hydroxybutan-2-yl)-2-methyl-5-(4-oxo-3H-phthalazin-1-yl)benzenesulfonamide Traditional Name: 5-(4-keto-3H-phthalazin-1-yl)-2-methyl-N-(1-methylolpropyl)benzenesulfonamide Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NS(=O)(=O)C1=C(C=CC(=C1)C2=NNC(=O)C3=CC=CC=C32)C

Isomeric SMILES

CCC(CO)NS(=O)(=O)C1=C(C=CC(=C1)C2=NNC(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C19H21N3O4S/c1-3-14(11-23)22-27(25,26)17-10-13(9-8-12(17)2)18-15-6-4-5-7-16(15)19(24)21-20-18/h4-10,14,22-23H,3,11H2,1-2H3,(H,21,24)