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2-Cyano-N-(4-{[(3,4-dimethylisoxazol-5-yl)amino]sulfonyl}phenyl)-2-(phenyl-hydrazono)acetamide
SpectraBase Compound ID z4J1J8rSva
InChI InChI=1S/C20H18N6O4S/c1-13-14(2)25-30-20(13)26-31(28,29)17-10-8-15(9-11-17)22-19(27)18(12-21)24-23-16-6-4-3-5-7-16/h3-11,23,26H,1-2H3,(H,22,27)/b24-18+
InChIKey QFXQCEZJLCHQQT-HKOYGPOVSA-N
Mol Weight 438.46 g/mol
Molecular Formula C20H18N6O4S
Exact Mass 438.111024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HlbnGnfS5HF
Name 2-Cyano-N-(4-{[(3,4-dimethylisoxazol-5-yl)amino]sulfonyl}phenyl)-2-(phenyl-hydrazono)acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18N6O4S
InChI InChI=1S/C20H18N6O4S/c1-13-14(2)25-30-20(13)26-31(28,29)17-10-8-15(9-11-17)22-19(27)18(12-21)24-23-16-6-4-3-5-7-16/h3-11,23,26H,1-2H3,(H,22,27)/b24-18+
InChIKey QFXQCEZJLCHQQT-HKOYGPOVSA-N
Molecular Weight 438.462 g/mol
SMILES N(c1c(c(C)no1)C)S(c1ccc(NC(\C(=N\Nc2ccccc2)C#N)=O)cc1)(=O)=O
SPLASH splash10-01x9-9422300000-d41b73183005854afc1d
Source of Spectrum EMC-84-501-9a
Synonyms (E)-2-((4-(N-(3,4-dimethylisoxazol-5-yl)sulfamoyl)phenyl)amino)-2-oxo-N'-phenylacetohydrazonoyl cyanide
Wiley ID 1740168