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(E)-2-oxo-N'-(5-sulfamoylquinolin-8-yl)propanehydrazonoyl cyanide
SpectraBase Compound ID ITTTjWgjS5V
InChI InChI=1S/C13H11N5O3S/c1-8(19)11(7-14)18-17-10-4-5-12(22(15,20)21)9-3-2-6-16-13(9)10/h2-6,17H,1H3,(H2,15,20,21)/b18-11+
InChIKey OQKJZJXXNXOVJP-WOJGMQOQSA-N
Mol Weight 317.32 g/mol
Molecular Formula C13H11N5O3S
Exact Mass 317.05826 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LHTtCWufsnd
Name (E)-2-oxo-N'-(5-sulfamoylquinolin-8-yl)propanehydrazonoyl cyanide
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Formula C13H11N5O3S
InChI InChI=1S/C13H11N5O3S/c1-8(19)11(7-14)18-17-10-4-5-12(22(15,20)21)9-3-2-6-16-13(9)10/h2-6,17H,1H3,(H2,15,20,21)/b18-11+
InChIKey OQKJZJXXNXOVJP-WOJGMQOQSA-N
Molecular Weight 317.323 g/mol
SMILES N(\N=C\(C(C)=O)C#N)c1ccc(S(N)(=O)=O)c2c1nccc2
SPLASH splash10-00dl-9781000000-1d26262dc32d0c357230
Source of Spectrum JX-2015-3-149
Synonyms 8-[(2E)-2-(1-cyano-2-oxopropylidene)hydrazinyl]-5-quinolinesulfonamide (1E)-2-oxo-N-[(5-sulfamoylquinolin-8-yl)amino]propanimidoyl cyanide (1E)-2-oxo-N-[(5-sulfamoyl-8-quinolyl)amino]propanimidoyl cyanide 8-[(2E)-2-(1-cyano-2-oxidanylidene-propylidene)hydrazinyl]quinoline-5-sulfonamide
Wiley ID 1723742