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

Details

Stereochemistry ACHIRAL
Molecular Formula C22H19ClNO3.Na
Molecular Weight 403.834
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GSK-345931A

SMILES

[Na+].CC(C)COC1=CC=C(Cl)C=C1C2=CC=CC=C2C3=CC=CC(=N3)C([O-])=O

InChI

InChIKey=HCPQFFJXXAUWBN-UHFFFAOYSA-M
InChI=1S/C22H20ClNO3.Na/c1-14(2)13-27-21-11-10-15(23)12-18(21)16-6-3-4-7-17(16)19-8-5-9-20(24-19)22(25)26;/h3-12,14H,13H2,1-2H3,(H,25,26);/q;+1/p-1

HIDE SMILES / InChI

Approval Year

Name Type Language
GSK-345931A
Common Name English
2-PYRIDINECARBOXYLIC ACID, 6-(5'-CHLORO-2'-(2-METHYLPROPOXY)(1,1'-BIPHENYL)-2-YL)-, SODIUM SALT
Preferred Name English
2-PYRIDINECARBOXYLIC ACID, 6-(5'-CHLORO-2'-(2-METHYLPROPOXY)(1,1'-BIPHENYL)-2-YL)-, SODIUM SALT (1:1)
Systematic Name English
Code System Code Type Description
PUBCHEM
23686961
Created by admin on Mon Mar 31 22:53:40 GMT 2025 , Edited by admin on Mon Mar 31 22:53:40 GMT 2025
PRIMARY
CAS
869499-38-7
Created by admin on Mon Mar 31 22:53:40 GMT 2025 , Edited by admin on Mon Mar 31 22:53:40 GMT 2025
PRIMARY
FDA UNII
U73BV4MML7
Created by admin on Mon Mar 31 22:53:40 GMT 2025 , Edited by admin on Mon Mar 31 22:53:40 GMT 2025
PRIMARY