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Details

Stereochemistry ACHIRAL
Molecular Formula C16H17NO5S
Molecular Weight 335.375
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Febuxostat Acid

SMILES

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

InChI

InChIKey=WSCLTDCYZOTAKS-UHFFFAOYSA-N
InChI=1S/C16H17NO5S/c1-8(2)7-22-12-5-4-10(6-11(12)15(18)19)14-17-9(3)13(23-14)16(20)21/h4-6,8H,7H2,1-3H3,(H,18,19)(H,20,21)

HIDE SMILES / InChI

Molecular Formula C16H17NO5S
Molecular Weight 335.375
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 20:51:50 GMT 2025
Edited
by admin
on Wed Apr 02 20:51:50 GMT 2025
Record UNII
TTX9KP3FGZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-[3-Carboxy-4-(2-methylpropoxy)phenyl]-4-methylthiazole-5-carboxylic acid [IUPAC]
Preferred Name English
Febuxostat Acid
Common Name English
Febuxostat Imp XXII
Common Name English
5-Thiazolecarboxylic acid, 2-[3-carboxy-4-(2-methylpropoxy)phenyl]-4-methyl- [INDEX-NAME]
Common Name English
Febuxostat Acid [USP Nickname]
Common Name English
Code System Code Type Description
FDA UNII
TTX9KP3FGZ
Created by admin on Wed Apr 02 20:51:50 GMT 2025 , Edited by admin on Wed Apr 02 20:51:50 GMT 2025
PRIMARY
PUBCHEM
46849410
Created by admin on Wed Apr 02 20:51:50 GMT 2025 , Edited by admin on Wed Apr 02 20:51:50 GMT 2025
PRIMARY
CAS
1239233-87-4
Created by admin on Wed Apr 02 20:51:50 GMT 2025 , Edited by admin on Wed Apr 02 20:51:50 GMT 2025
PRIMARY