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Details

Stereochemistry ACHIRAL
Molecular Formula C12H13N3O4S
Molecular Weight 295.314
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ACETYLSULFAMETHOXAZOLE

SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NOC(C)=C2

InChI

InChIKey=GXPIUNZCALHVBA-UHFFFAOYSA-N
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)

HIDE SMILES / InChI
Molecular Formula C12H13N3O4S
Molecular Weight 295.314
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
86413
Substance Class Chemical
Created
by admin
on Fri Dec 15 19:40:15 UTC 2023
Edited
by admin
on Fri Dec 15 19:40:15 UTC 2023
Record UNII
3I1988834Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACETYLSULFAMETHOXAZOLE
JAN  
Common Name English
SULFAMETHOXAZOLE IMPURITY A [EP IMPURITY]
Common Name English
ACETAMIDE, N-(4-(((5-METHYL-3-ISOXAZOLYL)AMINO)SULFONYL)PHENYL)-
Systematic Name English
SULFAMETHOXAZOLE N4-ACETYLSULFAMETHOXAZOLE
MI  
Common Name English
SULFAMETHOXAZOLE RELATED COMPOUND A [USP-RS]
Common Name English
N-(4-(((5-METHYLISOXAZOL-3-YL)AMINO)SULFONYL)PHENYL)ACETAMIDE
Systematic Name English
ACETANILIDE, 4'-((5-METHYL-3-ISOXAZOLYL)SULFAMOYL)-
Systematic Name English
N-(4-((5-METHYLISOXAZOL-3-YL)SULFAMOYL)PHENYL)ACETAMIDE
Systematic Name English
SULFAMETHOXAZOLE N4-ACETYLSULFAMETHOXAZOLE [MI]
Common Name English
N4-ACETYLSULFAMETHOXAZOLE
Common Name English
ACETYLSULFAMETHOXAZOLE [JAN]
Common Name English
SULFAMETHOXAZOLE RELATED COMPOUND A
USP-RS  
Common Name English
N-4-ACETYLSULPHAMETHOXAZOLE
Common Name English
4'-ACETYL-3-SULFA-5-METHYLISOXAZOLE
Systematic Name English
Code System Code Type Description
PUBCHEM
65280
Created by admin on Fri Dec 15 19:40:15 UTC 2023 , Edited by admin on Fri Dec 15 19:40:15 UTC 2023
PRIMARY
FDA UNII
3I1988834Q
Created by admin on Fri Dec 15 19:40:15 UTC 2023 , Edited by admin on Fri Dec 15 19:40:15 UTC 2023
PRIMARY
ChEMBL
CHEMBL443
Created by admin on Fri Dec 15 19:40:15 UTC 2023 , Edited by admin on Fri Dec 15 19:40:15 UTC 2023
PRIMARY
CAS
21312-10-7
Created by admin on Fri Dec 15 19:40:15 UTC 2023 , Edited by admin on Fri Dec 15 19:40:15 UTC 2023
PRIMARY
CHEBI
31169
Created by admin on Fri Dec 15 19:40:15 UTC 2023 , Edited by admin on Fri Dec 15 19:40:15 UTC 2023
PRIMARY
ECHA (EC/EINECS)
244-330-5
Created by admin on Fri Dec 15 19:40:15 UTC 2023 , Edited by admin on Fri Dec 15 19:40:15 UTC 2023
PRIMARY
RS_ITEM_NUM
1631511
Created by admin on Fri Dec 15 19:40:15 UTC 2023 , Edited by admin on Fri Dec 15 19:40:15 UTC 2023
PRIMARY
EPA CompTox
DTXSID8049044
Created by admin on Fri Dec 15 19:40:15 UTC 2023 , Edited by admin on Fri Dec 15 19:40:15 UTC 2023
PRIMARY
MERCK INDEX
m10320
Created by admin on Fri Dec 15 19:40:15 UTC 2023 , Edited by admin on Fri Dec 15 19:40:15 UTC 2023
PRIMARY Merck Index
Related Record Type Details
Structure of SULFAMETHOXAZOLE
PARENT -> METABOLITE
in slow acetylators, more parent drug is shunted toward the oxidative cytochrome P-450 pathway with the subsequent formation of the reactive hydroxylamine and nitroso metabolites. In a retrospective study, 90% of 21 patients who suffered from sulfa allergy were slow acetylators versus 55% in the general population, demonstrating an increased risk of ADRs to sulfonamides in slow acetylators.
Related Record Type Details
Structure of SULFAMETHOXAZOLE
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
NIH
NCATS
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