(E)-N-[1-[2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonylhydrazinyl]-1-oxidanylidene-propan-2-yl]-2-phenyl-ethenesulfonamide

Systemtic Name: (E)-N-[1-[2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonylhydrazinyl]-1-oxidanylidene-propan-2-yl]-2-phenyl-ethenesulfonamide Openeye Name: (E)-N-[1-methyl-2-[2-(3-methyl-4-oxo-phthalazine-1-carbonyl)hydrazino]-2-oxo-ethyl]-2-phenyl-ethenesulfonamide CAS Name: (E)-N-[1-[[(3-methyl-4-oxo-1-phthalazinyl)-oxomethyl]hydrazo]-1-oxopropan-2-yl]-2-phenylethenesulfonamide IUPAC Name: (E)-N-[1-[2-(3-methyl-4-oxophthalazine-1-carbonyl)hydrazinyl]-1-oxopropan-2-yl]-2-phenylethenesulfonamide Traditional Name: (E)-N-[2-keto-2-[N'-(4-keto-3-methyl-phthalazine-1-carbonyl)hydrazino]-1-methyl-ethyl]-2-phenyl-ethenesulfonamide Formula: C21H21N5O5S MolecularWeight: 455.48694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C)NS(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C)NS(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C21H21N5O5S/c1-14(25-32(30,31)13-12-15-8-4-3-5-9-15)19(27)22-23-20(28)18-16-10-6-7-11-17(16)21(29)26(2)24-18/h3-14,25H,1-2H3,(H,22,27)(H,23,28)/b13-12+