N-methyl-N-[2-oxidanylidene-2-[2-[(3-phenyl-1H-pyrazol-5-yl)carbonyl]hydrazinyl]ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-methyl-N-[2-oxidanylidene-2-[2-[(3-phenyl-1H-pyrazol-5-yl)carbonyl]hydrazinyl]ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-methyl-N-[2-oxo-2-[2-(3-phenyl-1H-pyrazole-5-carbonyl)hydrazino]ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-methyl-N-[2-oxo-2-[[oxo-(3-phenyl-1H-pyrazol-5-yl)methyl]hydrazo]ethyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-methyl-N-[2-oxo-2-[2-(3-phenyl-1H-pyrazole-5-carbonyl)hydrazinyl]ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[2-keto-2-[N'-(3-phenyl-1H-pyrazole-5-carbonyl)hydrazino]ethyl]-N-methyl-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C21H21N5O6S MolecularWeight: 471.48634

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NNC(=O)C1=CC(=NN1)C2=CC=CC=C2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CN(CC(=O)NNC(=O)C1=CC(=NN1)C2=CC=CC=C2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H21N5O6S/c1-26(33(29,30)15-7-8-18-19(11-15)32-10-9-31-18)13-20(27)24-25-21(28)17-12-16(22-23-17)14-5-3-2-4-6-14/h2-8,11-12H,9-10,13H2,1H3,(H,22,23)(H,24,27)(H,25,28)