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Details

Stereochemistry ACHIRAL
Molecular Formula C17H15N3O2S
Molecular Weight 325.385
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(4-(1-CYCLOPROPYLNAPHTHALEN-4-YL)-4H-1,2,4-TRIAZOL-3-YLTHIO)ACETIC ACID

SMILES

OC(=O)CSC1=NN=CN1C2=C3C=CC=CC3=C(C=C2)C4CC4

InChI

InChIKey=RQKGPEVPDVPLDT-UHFFFAOYSA-N
InChI=1S/C17H15N3O2S/c21-16(22)9-23-17-19-18-10-20(17)15-8-7-12(11-5-6-11)13-3-1-2-4-14(13)15/h1-4,7-8,10-11H,5-6,9H2,(H,21,22)

HIDE SMILES / InChI

Molecular Formula C17H15N3O2S
Molecular Weight 325.385
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 Sat Dec 16 13:39:09 GMT 2023
Edited
by admin
on Sat Dec 16 13:39:09 GMT 2023
Record UNII
2MPK9HG63C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(4-(1-CYCLOPROPYLNAPHTHALEN-4-YL)-4H-1,2,4-TRIAZOL-3-YLTHIO)ACETIC ACID
Systematic Name English
2-((4-(4-CYCLOPROPYL-1-NAPHTHALENYL)-4H-1,2,4-TRIAZOL-3-YL)THIO)ACETIC ACID
Systematic Name English
M2 METABOLITE OF LESINURAD
Common Name English
ACETIC ACID, 2-((4-(4-CYCLOPROPYL-1-NAPHTHALENYL)-4H-1,2,4-TRIAZOL-3-YL)THIO)-
Systematic Name English
2-((4-(4-CYCLOPROPYLNAPHTHALEN-1-YL)-4H-1,2,4-TRIAZOL-3-YL)THIO)ACETIC ACID
Systematic Name English
Code System Code Type Description
FDA UNII
2MPK9HG63C
Created by admin on Sat Dec 16 13:39:09 GMT 2023 , Edited by admin on Sat Dec 16 13:39:09 GMT 2023
PRIMARY
PUBCHEM
57811323
Created by admin on Sat Dec 16 13:39:09 GMT 2023 , Edited by admin on Sat Dec 16 13:39:09 GMT 2023
PRIMARY
CAS
1533519-93-5
Created by admin on Sat Dec 16 13:39:09 GMT 2023 , Edited by admin on Sat Dec 16 13:39:09 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
AMOUNT EXCRETED
FECAL
PARENT -> METABOLITE
AMOUNT EXCRETED
URINE