3-[[(4-oxidanylidene-3H-phthalazin-1-yl)carbonylamino]carbamoyl]-N-phenyl-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 3-[[(4-oxidanylidene-3H-phthalazin-1-yl)carbonylamino]carbamoyl]-N-phenyl-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-3-[[(4-oxo-3H-phthalazine-1-carbonyl)amino]carbamoyl]-N-phenyl-benzenesulfonamide CAS Name: 3-[oxo-[[oxo-(4-oxo-3H-phthalazin-1-yl)methyl]hydrazo]methyl]-N-phenyl-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-3-[[(4-oxo-3H-phthalazine-1-carbonyl)amino]carbamoyl]-N-phenylbenzenesulfonamide Traditional Name: N-benzyl-3-[[(4-keto-3H-phthalazine-1-carbonyl)amino]carbamoyl]-N-phenyl-benzenesulfonamide Formula: C29H23N5O5S MolecularWeight: 553.58842

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C(=O)NNC(=O)C4=NNC(=O)C5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)CN(C2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C(=O)NNC(=O)C4=NNC(=O)C5=CC=CC=C54

InChI

InChI=1S/C29H23N5O5S/c35-27(31-33-29(37)26-24-16-7-8-17-25(24)28(36)32-30-26)21-12-9-15-23(18-21)40(38,39)34(22-13-5-2-6-14-22)19-20-10-3-1-4-11-20/h1-18H,19H2,(H,31,35)(H,32,36)(H,33,37)