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

Systemtic Name: N-ethyl-3-[[(3-ethyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]carbamoyl]-4-methyl-benzenesulfonamide Openeye Name: N-ethyl-3-[[(3-ethyl-4-oxo-phthalazine-1-carbonyl)amino]carbamoyl]-4-methyl-benzenesulfonamide CAS Name: N-ethyl-3-[[[(3-ethyl-4-oxo-1-phthalazinyl)-oxomethyl]hydrazo]-oxomethyl]-4-methylbenzenesulfonamide IUPAC Name: N-ethyl-3-[[(3-ethyl-4-oxophthalazine-1-carbonyl)amino]carbamoyl]-4-methylbenzenesulfonamide Traditional Name: N-ethyl-3-[[(3-ethyl-4-keto-phthalazine-1-carbonyl)amino]carbamoyl]-4-methyl-benzenesulfonamide Formula: C21H23N5O5S MolecularWeight: 457.50282

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Descriptors Computed from Structure

Canonical SMILES:

CCNS(=O)(=O)C1=CC(=C(C=C1)C)C(=O)NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC

Isomeric SMILES

CCNS(=O)(=O)C1=CC(=C(C=C1)C)C(=O)NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC

InChI

InChI=1S/C21H23N5O5S/c1-4-22-32(30,31)14-11-10-13(3)17(12-14)19(27)23-24-20(28)18-15-8-6-7-9-16(15)21(29)26(5-2)25-18/h6-12,22H,4-5H2,1-3H3,(H,23,27)(H,24,28)