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

Details

Stereochemistry ACHIRAL
Molecular Formula C23H29NO3S
Molecular Weight 399.546
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MRS-1523

SMILES

CCCOC(=O)C1=C(CCC)C(C(=O)SCC)=C(CC)N=C1C2=CC=CC=C2

InChI

InChIKey=UUSHFEVEROROSP-UHFFFAOYSA-N
InChI=1S/C23H29NO3S/c1-5-12-17-19(23(26)28-8-4)18(7-3)24-21(16-13-10-9-11-14-16)20(17)22(25)27-15-6-2/h9-11,13-14H,5-8,12,15H2,1-4H3

HIDE SMILES / InChI

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
147.0 nM [Ki]
Name Type Language
MRS-1523
Code English
3-PYRIDINECARBOXYLIC ACID, 6-ETHYL-5-((ETHYLTHIO)CARBONYL)-2-PHENYL-4-PROPYL-, PROPYL ESTER
Systematic Name English
MRS 1523
Code English
PROPYL 6-ETHYL-5-((ETHYLTHIO)CARBONYL)-2-PHENYL-4-PROPYL-3-PYRIDINECARBOXYLATE
Systematic Name English
Code System Code Type Description
CAS
212329-37-8
Created by admin on Sat Dec 16 08:16:48 GMT 2023 , Edited by admin on Sat Dec 16 08:16:48 GMT 2023
PRIMARY
EPA CompTox
DTXSID501017166
Created by admin on Sat Dec 16 08:16:48 GMT 2023 , Edited by admin on Sat Dec 16 08:16:48 GMT 2023
PRIMARY
PUBCHEM
3661570
Created by admin on Sat Dec 16 08:16:48 GMT 2023 , Edited by admin on Sat Dec 16 08:16:48 GMT 2023
PRIMARY
FDA UNII
6D9Q2QUU75
Created by admin on Sat Dec 16 08:16:48 GMT 2023 , Edited by admin on Sat Dec 16 08:16:48 GMT 2023
PRIMARY