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

Details

Stereochemistry RACEMIC
Molecular Formula C20H31NO2S.C6H8O7
Molecular Weight 541.654
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CETIEDIL CITRATE

SMILES

OC(=O)CC(O)(CC(O)=O)C(O)=O.O=C(OCCN1CCCCCC1)C(C2CCCCC2)C3=CSC=C3

InChI

InChIKey=XMGJGSKRRWXOIF-UHFFFAOYSA-N
InChI=1S/C20H31NO2S.C6H8O7/c22-20(23-14-13-21-11-6-1-2-7-12-21)19(18-10-15-24-16-18)17-8-4-3-5-9-17;7-3(8)1-6(13,5(11)12)2-4(9)10/h10,15-17,19H,1-9,11-14H2;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)

HIDE SMILES / InChI
Cetiedil is effective potassium channel blocker used as a peripheral vasodilator to treat patients with painful crises in sickle cell anemia and pain in the extremities caused by an arterial disease. Known pharmacological properties of the drug include vascular smooth muscle relaxation, inhibition of phosphodiesterase with the consequent increase in circulating cyclic AMP concentration, blockade of the effect of bradykinin and serotonin, analgesia, inhibition of platelet aggregation and the decrease of plasma and blood viscosity and plasma fibrinogen level. The antisickling effect of cetiedil is explained mainly in the light of the changes it induces in the activities of membrane-bound ATPases and the permeability properties of the erythrocyte membrane to cations and anions.

Approval Year

PubMed

PubMed

TitleDatePubMed
Synthesis and structure-activity relationships of cetiedil analogues as blockers of the Ca(2+)-activated K+ permeability of erythrocytes.
2001 Sep 27
Inhibition of the antigen-induced activation of RBL-2H3 cells by cetiedil and some of its analogues.
2004 Jan 12
Pharmacology of the human red cell voltage-dependent cation channel; Part I. Activation by clotrimazole and analogues.
2004 May-Jun
Name Type Language
CETIEDIL CITRATE
MART.   MI   USAN   WHO-DD  
USAN  
Official Name English
STRATENE
Brand Name English
3-THIOPHENEACETIC ACID, .ALPHA.-CYCLOHEXYL-, 2-(HEXAHYDRO-1H-AZEPIN-1-YL)ETHYL ESTER, 2-HYDROXY-1,2,3-PROPANETRICARBOXYLATE (1:1)
Common Name English
VASOCET
Brand Name English
CETIEDIL CITRATE [USAN]
Common Name English
CELSIS
Brand Name English
CETIEDIL CITRATE [MI]
Common Name English
CETIEDIL CITRATE [MART.]
Common Name English
2-(Hexahydro-1H-azepin-1-yl)ethyl α-cyclohexyl-3-thiopheneacetate citrate (1:1)
Systematic Name English
Cetiedil citrate [WHO-DD]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C29707
Created by admin on Fri Dec 15 17:40:24 GMT 2023 , Edited by admin on Fri Dec 15 17:40:24 GMT 2023
FDA ORPHAN DRUG 31488
Created by admin on Fri Dec 15 17:40:24 GMT 2023 , Edited by admin on Fri Dec 15 17:40:24 GMT 2023
Code System Code Type Description
CAS
16286-69-4
Created by admin on Fri Dec 15 17:40:24 GMT 2023 , Edited by admin on Fri Dec 15 17:40:24 GMT 2023
PRIMARY
ChEMBL
CHEMBL419380
Created by admin on Fri Dec 15 17:40:24 GMT 2023 , Edited by admin on Fri Dec 15 17:40:24 GMT 2023
PRIMARY
PUBCHEM
66383
Created by admin on Fri Dec 15 17:40:24 GMT 2023 , Edited by admin on Fri Dec 15 17:40:24 GMT 2023
PRIMARY
MERCK INDEX
m3289
Created by admin on Fri Dec 15 17:40:24 GMT 2023 , Edited by admin on Fri Dec 15 17:40:24 GMT 2023
PRIMARY Merck Index
RXCUI
236204
Created by admin on Fri Dec 15 17:40:24 GMT 2023 , Edited by admin on Fri Dec 15 17:40:24 GMT 2023
PRIMARY RxNorm
EPA CompTox
DTXSID20936756
Created by admin on Fri Dec 15 17:40:24 GMT 2023 , Edited by admin on Fri Dec 15 17:40:24 GMT 2023
PRIMARY
FDA UNII
IE65P4OE02
Created by admin on Fri Dec 15 17:40:24 GMT 2023 , Edited by admin on Fri Dec 15 17:40:24 GMT 2023
PRIMARY
NCI_THESAURUS
C79585
Created by admin on Fri Dec 15 17:40:24 GMT 2023 , Edited by admin on Fri Dec 15 17:40:24 GMT 2023
PRIMARY
ECHA (EC/EINECS)
240-381-2
Created by admin on Fri Dec 15 17:40:24 GMT 2023 , Edited by admin on Fri Dec 15 17:40:24 GMT 2023
PRIMARY