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Details

Stereochemistry ACHIRAL
Molecular Formula C24H23NO5S
Molecular Weight 437.508
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-[[3-[(4-Acetyl-3-hydroxy-2-propylphenoxy)methyl]phenyl]thio]-4-pyridinecarboxylic acid

SMILES

CCCC1=C(O)C(=CC=C1OCC2=CC=CC(SC3=NC=CC(=C3)C(O)=O)=C2)C(C)=O

InChI

InChIKey=GWUBYTJAQIRROB-UHFFFAOYSA-N
InChI=1S/C24H23NO5S/c1-3-5-20-21(9-8-19(15(2)26)23(20)27)30-14-16-6-4-7-18(12-16)31-22-13-17(24(28)29)10-11-25-22/h4,6-13,27H,3,5,14H2,1-2H3,(H,28,29)

HIDE SMILES / InChI

Approval Year

Name Type Language
4-Pyridinecarboxylic acid, 2-[[3-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]phenyl]thio]-
Preferred Name English
2-[[3-[(4-Acetyl-3-hydroxy-2-propylphenoxy)methyl]phenyl]thio]-4-pyridinecarboxylic acid
Systematic Name English
2-[[3-[(4-Acetyl-3-hydroxy-2-propylphenoxy)methyl]phenyl]sulfanyl]isonicotinic acid
Systematic Name English
Code System Code Type Description
PUBCHEM
59599563
Created by admin on Wed Apr 02 20:04:28 GMT 2025 , Edited by admin on Wed Apr 02 20:04:28 GMT 2025
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SMS_ID
300000052390
Created by admin on Wed Apr 02 20:04:28 GMT 2025 , Edited by admin on Wed Apr 02 20:04:28 GMT 2025
PRIMARY
CAS
888967-23-5
Created by admin on Wed Apr 02 20:04:28 GMT 2025 , Edited by admin on Wed Apr 02 20:04:28 GMT 2025
PRIMARY
FDA UNII
B9ZU7GL7SK
Created by admin on Wed Apr 02 20:04:28 GMT 2025 , Edited by admin on Wed Apr 02 20:04:28 GMT 2025
PRIMARY