3-[[(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonylamino]carbamoyl]-N-prop-2-enyl-benzenesulfonamide

Systemtic Name: 3-[[(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonylamino]carbamoyl]-N-prop-2-enyl-benzenesulfonamide Openeye Name: N-allyl-3-[[(4-oxo-3-pentyl-phthalazine-1-carbonyl)amino]carbamoyl]benzenesulfonamide CAS Name: 3-[oxo-[[oxo-(4-oxo-3-pentyl-1-phthalazinyl)methyl]hydrazo]methyl]-N-prop-2-enylbenzenesulfonamide IUPAC Name: 3-[[(4-oxo-3-pentylphthalazine-1-carbonyl)amino]carbamoyl]-N-prop-2-enylbenzenesulfonamide Traditional Name: N-allyl-3-[[(3-amyl-4-keto-phthalazine-1-carbonyl)amino]carbamoyl]benzenesulfonamide Formula: C24H27N5O5S MolecularWeight: 497.56668

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27N5O5S/c1-3-5-8-15-29-24(32)20-13-7-6-12-19(20)21(28-29)23(31)27-26-22(30)17-10-9-11-18(16-17)35(33,34)25-14-4-2/h4,6-7,9-13,16,25H,2-3,5,8,14-15H2,1H3,(H,26,30)(H,27,31)