4-[[(3-ethyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]carbamoyl]-N-(2-methylpropyl)benzenesulfonamide

Systemtic Name: 4-[[(3-ethyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]carbamoyl]-N-(2-methylpropyl)benzenesulfonamide Openeye Name: 4-[[(3-ethyl-4-oxo-phthalazine-1-carbonyl)amino]carbamoyl]-N-isobutyl-benzenesulfonamide CAS Name: 4-[[[(3-ethyl-4-oxo-1-phthalazinyl)-oxomethyl]hydrazo]-oxomethyl]-N-(2-methylpropyl)benzenesulfonamide IUPAC Name: 4-[[(3-ethyl-4-oxophthalazine-1-carbonyl)amino]carbamoyl]-N-(2-methylpropyl)benzenesulfonamide Traditional Name: 4-[[(3-ethyl-4-keto-phthalazine-1-carbonyl)amino]carbamoyl]-N-isobutyl-benzenesulfonamide Formula: C22H25N5O5S MolecularWeight: 471.5294

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC=C(C=C3)S(=O)(=O)NCC(C)C

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC=C(C=C3)S(=O)(=O)NCC(C)C

InChI

InChI=1S/C22H25N5O5S/c1-4-27-22(30)18-8-6-5-7-17(18)19(26-27)21(29)25-24-20(28)15-9-11-16(12-10-15)33(31,32)23-13-14(2)3/h5-12,14,23H,4,13H2,1-3H3,(H,24,28)(H,25,29)