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

Systemtic Name: N-tert-butyl-4-[[(3-ethyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]carbamoyl]benzenesulfonamide Openeye Name: N-tert-butyl-4-[[(3-ethyl-4-oxo-phthalazine-1-carbonyl)amino]carbamoyl]benzenesulfonamide CAS Name: N-tert-butyl-4-[[[(3-ethyl-4-oxo-1-phthalazinyl)-oxomethyl]hydrazo]-oxomethyl]benzenesulfonamide IUPAC Name: N-tert-butyl-4-[[(3-ethyl-4-oxophthalazine-1-carbonyl)amino]carbamoyl]benzenesulfonamide Traditional Name: N-tert-butyl-4-[[(3-ethyl-4-keto-phthalazine-1-carbonyl)amino]carbamoyl]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)NC(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C22H25N5O5S/c1-5-27-21(30)17-9-7-6-8-16(17)18(25-27)20(29)24-23-19(28)14-10-12-15(13-11-14)33(31,32)26-22(2,3)4/h6-13,26H,5H2,1-4H3,(H,23,28)(H,24,29)