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2-Cyano-N-(4-{[(3,4-dimethylisoxazol-5-yl)amino]sulfonyl}phenyl)-2-[(4-ethoxy-phenyl)hydrazono]acetamide
SpectraBase Compound ID 7Azurw4TfH3
InChI InChI=1S/C22H22N6O5S/c1-4-32-18-9-5-17(6-10-18)25-26-20(13-23)21(29)24-16-7-11-19(12-8-16)34(30,31)28-22-14(2)15(3)27-33-22/h5-12,25,28H,4H2,1-3H3,(H,24,29)/b26-20+
InChIKey UMXBHYCGUMAZDA-LHLOQNFPSA-N
Mol Weight 482.52 g/mol
Molecular Formula C22H22N6O5S
Exact Mass 482.137239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3lBmdcSzfcy
Name 2-Cyano-N-(4-{[(3,4-dimethylisoxazol-5-yl)amino]sulfonyl}phenyl)-2-[(4-ethoxy-phenyl)hydrazono]acetamide
Alternate Name(s) (E)-2-((4-(N-(3,4-dimethylisoxazol-5-yl)sulfamoyl)phenyl)amino)-N'-(4-ethoxyphenyl)-2-oxoacetohydrazonoyl cyanide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22N6O5S
InChI InChI=1S/C22H22N6O5S/c1-4-32-18-9-5-17(6-10-18)25-26-20(13-23)21(29)24-16-7-11-19(12-8-16)34(30,31)28-22-14(2)15(3)27-33-22/h5-12,25,28H,4H2,1-3H3,(H,24,29)/b26-20+
InChIKey UMXBHYCGUMAZDA-LHLOQNFPSA-N
Molecular Weight 482.515 g/mol
SMILES N(c1c(c(C)no1)C)S(c1ccc(NC(\C(=N\Nc2ccc(cc2)OCC)C#N)=O)cc1)(=O)=O
SPLASH splash10-0a4i-0900000000-01396111c89106ce48b3
Source of Spectrum EMC-84-502-9d
Wiley ID 1740165