3-[[(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonylamino]sulfamoyl]benzenesulfonamide

Systemtic Name: 3-[[(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonylamino]sulfamoyl]benzenesulfonamide Openeye Name: 3-[[(4-oxo-3-pentyl-phthalazine-1-carbonyl)amino]sulfamoyl]benzenesulfonamide CAS Name: 3-[[[oxo-(4-oxo-3-pentyl-1-phthalazinyl)methyl]amino]sulfamoyl]benzenesulfonamide IUPAC Name: 3-[[(4-oxo-3-pentylphthalazine-1-carbonyl)amino]sulfamoyl]benzenesulfonamide Traditional Name: 3-[[(3-amyl-4-keto-phthalazine-1-carbonyl)amino]sulfamoyl]benzenesulfonamide Formula: C20H23N5O6S2 MolecularWeight: 493.55652

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNS(=O)(=O)C3=CC=CC(=C3)S(=O)(=O)N

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNS(=O)(=O)C3=CC=CC(=C3)S(=O)(=O)N

InChI

InChI=1S/C20H23N5O6S2/c1-2-3-6-12-25-20(27)17-11-5-4-10-16(17)18(23-25)19(26)22-24-33(30,31)15-9-7-8-14(13-15)32(21,28)29/h4-5,7-11,13,24H,2-3,6,12H2,1H3,(H,22,26)(H2,21,28,29)