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

Details

Stereochemistry RACEMIC
Molecular Formula C20H31NO2S
Molecular Weight 349.531
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CETIEDIL

SMILES

O=C(OCCN1CCCCCC1)C(C2CCCCC2)C3=CSC=C3

InChI

InChIKey=MMNICIJVQJJHHF-UHFFFAOYSA-N
InChI=1S/C20H31NO2S/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/h10,15-17,19H,1-9,11-14H2

HIDE SMILES / InChI

Molecular Formula C20H31NO2S
Molecular Weight 349.531
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

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
Substance Class Chemical
Created
by admin
on Fri Dec 15 17:05:24 GMT 2023
Edited
by admin
on Fri Dec 15 17:05:24 GMT 2023
Record UNII
621RT200TO
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CETIEDIL
INN   MI   WHO-DD  
INN  
Official Name English
cetiedil [INN]
Common Name English
3-THIOPHENEACETIC ACID, .ALPHA.-CYCLOHEXYL-, 2-(HEXAHYDRO-1H-AZEPIN-1-YL)ETHYL ESTER
Common Name English
2-(HEXAHYDRO-1H-AZEPIN-1-YL)ETHYL .ALPHA.-CYCLOHEXYL-3-THIOPHENEACETATE
Systematic Name English
Cetiedil [WHO-DD]
Common Name English
CETIEDIL [MI]
Common Name English
Classification Tree Code System Code
WHO-VATC QC04AX26
Created by admin on Fri Dec 15 17:05:24 GMT 2023 , Edited by admin on Fri Dec 15 17:05:24 GMT 2023
NCI_THESAURUS C29707
Created by admin on Fri Dec 15 17:05:24 GMT 2023 , Edited by admin on Fri Dec 15 17:05:24 GMT 2023
WHO-ATC C04AX26
Created by admin on Fri Dec 15 17:05:24 GMT 2023 , Edited by admin on Fri Dec 15 17:05:24 GMT 2023
Code System Code Type Description
CAS
14176-10-4
Created by admin on Fri Dec 15 17:05:24 GMT 2023 , Edited by admin on Fri Dec 15 17:05:24 GMT 2023
PRIMARY
EVMPD
SUB07450MIG
Created by admin on Fri Dec 15 17:05:24 GMT 2023 , Edited by admin on Fri Dec 15 17:05:24 GMT 2023
PRIMARY
FDA UNII
621RT200TO
Created by admin on Fri Dec 15 17:05:24 GMT 2023 , Edited by admin on Fri Dec 15 17:05:24 GMT 2023
PRIMARY
INN
3171
Created by admin on Fri Dec 15 17:05:24 GMT 2023 , Edited by admin on Fri Dec 15 17:05:24 GMT 2023
PRIMARY
PUBCHEM
66384
Created by admin on Fri Dec 15 17:05:24 GMT 2023 , Edited by admin on Fri Dec 15 17:05:24 GMT 2023
PRIMARY
ECHA (EC/EINECS)
238-028-2
Created by admin on Fri Dec 15 17:05:24 GMT 2023 , Edited by admin on Fri Dec 15 17:05:24 GMT 2023
PRIMARY
DRUG BANK
DB13753
Created by admin on Fri Dec 15 17:05:24 GMT 2023 , Edited by admin on Fri Dec 15 17:05:24 GMT 2023
PRIMARY
DRUG CENTRAL
580
Created by admin on Fri Dec 15 17:05:24 GMT 2023 , Edited by admin on Fri Dec 15 17:05:24 GMT 2023
PRIMARY
NCI_THESAURUS
C79584
Created by admin on Fri Dec 15 17:05:24 GMT 2023 , Edited by admin on Fri Dec 15 17:05:24 GMT 2023
PRIMARY
ChEMBL
CHEMBL419380
Created by admin on Fri Dec 15 17:05:24 GMT 2023 , Edited by admin on Fri Dec 15 17:05:24 GMT 2023
PRIMARY
RXCUI
20609
Created by admin on Fri Dec 15 17:05:24 GMT 2023 , Edited by admin on Fri Dec 15 17:05:24 GMT 2023
PRIMARY RxNorm
MERCK INDEX
m3289
Created by admin on Fri Dec 15 17:05:24 GMT 2023 , Edited by admin on Fri Dec 15 17:05:24 GMT 2023
PRIMARY Merck Index
WIKIPEDIA
CETIEDIL
Created by admin on Fri Dec 15 17:05:24 GMT 2023 , Edited by admin on Fri Dec 15 17:05:24 GMT 2023
PRIMARY
EPA CompTox
DTXSID70864474
Created by admin on Fri Dec 15 17:05:24 GMT 2023 , Edited by admin on Fri Dec 15 17:05:24 GMT 2023
PRIMARY
SMS_ID
100000081512
Created by admin on Fri Dec 15 17:05:24 GMT 2023 , Edited by admin on Fri Dec 15 17:05:24 GMT 2023
PRIMARY
MESH
C006955
Created by admin on Fri Dec 15 17:05:24 GMT 2023 , Edited by admin on Fri Dec 15 17:05:24 GMT 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE
SALT/SOLVATE -> PARENT
SALT/SOLVATE -> PARENT
SALT/SOLVATE -> PARENT
ENANTIOMER -> RACEMATE
Related Record Type Details
ACTIVE MOIETY