N4-Acetylsulfamethoxazole

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Systematic / IUPAC Name: N-{4-[(5-Methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl}acetamide

ID: Reference1097

Other Names: N4-Acetylsulfisomezole;
N-(4-{[(5-Methylisoxazol-3-yl)amino]sulphonyl}phenyl)acetamide ;
N-{4-[N-(5-Methylisoxazol-3-yl)sulfamoyl]phenyl}acetamide ;
N-(4-{[(5-Methyl-3-isoxazolyl)amino]sulfonyl}phenyl)acetamide;
N-{4-[(5-Methylisoxazol-3-yl)sulfamoyl]phenyl}acetamide ; more

Formula: C12H13N3O4S

Class: Therapeutics/Prescription Drugs

Spectral Data

N4-Acetylsulfamethoxazole mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments LTQ Orbitrap XL; Orbitrap Fusion Lumos with ETD LBP FAIMS
No. of Spectral Trees 4
No. of Spectra 3338
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods ESI; NSI
Analyzers FT
Last Modification 10/14/2016 12:45:18 PM
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Identificators

InChI InChI=1S/C12H13N3O4S/c1-8-7-12(14-19-8)15-20(17,18)11-5-3-10(4-6-11)13-9(2)16/h3-7H,1-2H3,(H,13,16)(H,14,15)
InChI Key GXPIUNZCALHVBA-UHFFFAOYSA-N
Canonical SMILES CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C
CAS 21312107
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Other Names N4-Acetylsulfisomezole;
N-(4-{[(5-Methylisoxazol-3-yl)amino]sulphonyl}phenyl)acetamide ;
N-{4-[N-(5-Methylisoxazol-3-yl)sulfamoyl]phenyl}acetamide ;
N-(4-{[(5-Methyl-3-isoxazolyl)amino]sulfonyl}phenyl)acetamide;
N-{4-[(5-Methylisoxazol-3-yl)sulfamoyl]phenyl}acetamide;
N-Acetyl sulfamethoxazole;
4-Acetylamino-N-(5-methyl-3-isoxazolyl)benzenesulfonamide;
Acetamide, N-(4-{[(5-methyl-3-isoxazolyl)amino]sulfonyl}phenyl)- ;
Acetylsulfamethoxazole;
Sulfamethoxazole acetate

In Other Databases

ChemIDPlus 021312107
HMDb HMDB13854
KEGG C13061; D01601
ChemSpider 58771
ChEBI CHEBI:31169
PubChem 65280