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

Systemtic Name: N-cyclopropyl-4-[[(4-oxidanylidene-3-propan-2-yl-phthalazin-1-yl)carbonylamino]carbamoyl]benzenesulfonamide Openeye Name: N-cyclopropyl-4-[[(3-isopropyl-4-oxo-phthalazine-1-carbonyl)amino]carbamoyl]benzenesulfonamide CAS Name: N-cyclopropyl-4-[oxo-[[oxo-(4-oxo-3-propan-2-yl-1-phthalazinyl)methyl]hydrazo]methyl]benzenesulfonamide IUPAC Name: N-cyclopropyl-4-[[(4-oxo-3-propan-2-ylphthalazine-1-carbonyl)amino]carbamoyl]benzenesulfonamide Traditional Name: N-cyclopropyl-4-[[(3-isopropyl-4-keto-phthalazine-1-carbonyl)amino]carbamoyl]benzenesulfonamide Formula: C22H23N5O5S MolecularWeight: 469.51352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC=C(C=C3)S(=O)(=O)NC4CC4

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC=C(C=C3)S(=O)(=O)NC4CC4

InChI

InChI=1S/C22H23N5O5S/c1-13(2)27-22(30)18-6-4-3-5-17(18)19(25-27)21(29)24-23-20(28)14-7-11-16(12-8-14)33(31,32)26-15-9-10-15/h3-8,11-13,15,26H,9-10H2,1-2H3,(H,23,28)(H,24,29)