U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C15H17NO3S
Molecular Weight 291.365
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Descyano Febuxostat

SMILES

CC(C)COC1=CC=C(C=C1)C2=NC(C)=C(S2)C(O)=O

InChI

InChIKey=ZDKJCYASUIQELO-UHFFFAOYSA-N
InChI=1S/C15H17NO3S/c1-9(2)8-19-12-6-4-11(5-7-12)14-16-10(3)13(20-14)15(17)18/h4-7,9H,8H2,1-3H3,(H,17,18)

HIDE SMILES / InChI

Molecular Formula C15H17NO3S
Molecular Weight 291.365
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:09:06 GMT 2025
Edited
by admin
on Wed Apr 02 19:09:06 GMT 2025
Record UNII
ZPS8579DJ5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-[4-(2-Methylpropoxy)phenyl]-4-methylthiazole-5-carboxylic acid [IUPAC]
Preferred Name English
Descyano Febuxostat
Common Name English
Descyano Febuxostat [USP Nickname]
Common Name English
5-Thiazolecarboxylic acid, 4-methyl-2-[4-(2-methylpropoxy)phenyl]- [INDEX-NAME]
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID801170852
Created by admin on Wed Apr 02 19:09:06 GMT 2025 , Edited by admin on Wed Apr 02 19:09:06 GMT 2025
PRIMARY
CAS
1206550-99-3
Created by admin on Wed Apr 02 19:09:06 GMT 2025 , Edited by admin on Wed Apr 02 19:09:06 GMT 2025
PRIMARY
PUBCHEM
95492613
Created by admin on Wed Apr 02 19:09:06 GMT 2025 , Edited by admin on Wed Apr 02 19:09:06 GMT 2025
PRIMARY
FDA UNII
ZPS8579DJ5
Created by admin on Wed Apr 02 19:09:06 GMT 2025 , Edited by admin on Wed Apr 02 19:09:06 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CI file
USP