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

Systemtic Name: N-methyl-3-[[[4-oxidanylidene-3-(phenylmethyl)phthalazin-1-yl]carbonylamino]carbamoyl]benzenesulfonamide Openeye Name: 3-[[(3-benzyl-4-oxo-phthalazine-1-carbonyl)amino]carbamoyl]-N-methyl-benzenesulfonamide CAS Name: N-methyl-3-[oxo-[[oxo-[4-oxo-3-(phenylmethyl)-1-phthalazinyl]methyl]hydrazo]methyl]benzenesulfonamide IUPAC Name: 3-[[(3-benzyl-4-oxophthalazine-1-carbonyl)amino]carbamoyl]-N-methylbenzenesulfonamide Traditional Name: 3-[[(3-benzyl-4-keto-phthalazine-1-carbonyl)amino]carbamoyl]-N-methyl-benzenesulfonamide Formula: C24H21N5O5S MolecularWeight: 491.51904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

CNS(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C24H21N5O5S/c1-25-35(33,34)18-11-7-10-17(14-18)22(30)26-27-23(31)21-19-12-5-6-13-20(19)24(32)29(28-21)15-16-8-3-2-4-9-16/h2-14,25H,15H2,1H3,(H,26,30)(H,27,31)