4-methoxy-3-[[(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonylamino]carbamoyl]benzenesulfonamide

Systemtic Name: 4-methoxy-3-[[(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonylamino]carbamoyl]benzenesulfonamide Openeye Name: 4-methoxy-3-[[(4-oxo-3-pentyl-phthalazine-1-carbonyl)amino]carbamoyl]benzenesulfonamide CAS Name: 4-methoxy-3-[oxo-[[oxo-(4-oxo-3-pentyl-1-phthalazinyl)methyl]hydrazo]methyl]benzenesulfonamide IUPAC Name: 4-methoxy-3-[[(4-oxo-3-pentylphthalazine-1-carbonyl)amino]carbamoyl]benzenesulfonamide Traditional Name: 3-[[(3-amyl-4-keto-phthalazine-1-carbonyl)amino]carbamoyl]-4-methoxy-benzenesulfonamide Formula: C22H25N5O6S MolecularWeight: 487.5288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=C(C=CC(=C3)S(=O)(=O)N)OC

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=C(C=CC(=C3)S(=O)(=O)N)OC

InChI

InChI=1S/C22H25N5O6S/c1-3-4-7-12-27-22(30)16-9-6-5-8-15(16)19(26-27)21(29)25-24-20(28)17-13-14(34(23,31)32)10-11-18(17)33-2/h5-6,8-11,13H,3-4,7,12H2,1-2H3,(H,24,28)(H,25,29)(H2,23,31,32)