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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)NCCC(=O)NNC(=O)C3=CC(=NN3)C4=CC=CC=C4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)NCCC(=O)NNC(=O)C3=CC(=NN3)C4=CC=CC=C4

InChI

InChI=1S/C21H21N5O6S/c27-20(25-26-21(28)17-13-16(23-24-17)14-4-2-1-3-5-14)8-9-22-33(29,30)15-6-7-18-19(12-15)32-11-10-31-18/h1-7,12-13,22H,8-11H2,(H,23,24)(H,25,27)(H,26,28)