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2095166-41-7

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2095166-41-7 Structure

2095166-41-7 Structure
IdentificationBack Directory
[Name]

5-(5-(ethoxycarbonyl)-4-methylthiazol-2-yl)-2-isobutoxybenzoic acid
[CAS]

2095166-41-7
[Synonyms]

Febuxostat-53
Febuxostat Impurity 55
Febuxostat Impurity 118
Febuxostat Acid Ester Impurity
5-(5-(ethoxycarbonyl)-4-methylthiazol-2-yl)-2-isobutoxybenzoic acid
Febuxostat Impurity 54/5-(5-(ethoxycarbonyl)-4-methylthiazol-2-yl)-2-isobutoxybenzoic acid
5-Thiazolecarboxylic acid, 2-[3-carboxy-4-(2-methylpropoxy)phenyl]-4-methyl-, 5-ethyl ester
[Molecular Formula]

C18H21NO5S
[MOL File]

2095166-41-7.mol
[Molecular Weight]

363.43
Chemical PropertiesBack Directory
[InChI]

InChI=1S/C18H21NO5S/c1-5-23-18(22)15-11(4)19-16(25-15)12-6-7-14(24-9-10(2)3)13(8-12)17(20)21/h6-8,10H,5,9H2,1-4H3,(H,20,21)
[InChIKey]

OASPMNAZNMMXTD-UHFFFAOYSA-N
[SMILES]

S1C(C(OCC)=O)=C(C)N=C1C1=CC=C(OCC(C)C)C(C(O)=O)=C1
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