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

Details

Stereochemistry MIXED
Molecular Formula C22H36N2O3
Molecular Weight 376.5328
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FENETRADIL

SMILES

CCC(C(=O)OC(COCC(C)C)CN1CCN(C)CC1)C2=CC=CC=C2

InChI

InChIKey=JAHOJXDGNNONSL-UHFFFAOYSA-N
InChI=1S/C22H36N2O3/c1-5-21(19-9-7-6-8-10-19)22(25)27-20(17-26-16-18(2)3)15-24-13-11-23(4)12-14-24/h6-10,18,20-21H,5,11-17H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C22H36N2O3
Molecular Weight 376.5328
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

FENETRADIL is a coronary dilator.

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:21:23 GMT 2023
Edited
by admin
on Fri Dec 15 16:21:23 GMT 2023
Record UNII
9GXY5Z0873
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FENETRADIL
INN  
INN  
Official Name English
fenetradil [INN]
Common Name English
1-(ISOBUTOXYMETHYL)-2-(4-METHYL-1-PIPERAZINYL)ETHYL 2-PHENYLBUTYRATE
Systematic Name English
Classification Tree Code System Code
NCI_THESAURUS C29707
Created by admin on Fri Dec 15 16:21:23 GMT 2023 , Edited by admin on Fri Dec 15 16:21:23 GMT 2023
Code System Code Type Description
NCI_THESAURUS
C65647
Created by admin on Fri Dec 15 16:21:23 GMT 2023 , Edited by admin on Fri Dec 15 16:21:23 GMT 2023
PRIMARY
SMS_ID
100000081272
Created by admin on Fri Dec 15 16:21:23 GMT 2023 , Edited by admin on Fri Dec 15 16:21:23 GMT 2023
PRIMARY
EVMPD
SUB07559MIG
Created by admin on Fri Dec 15 16:21:23 GMT 2023 , Edited by admin on Fri Dec 15 16:21:23 GMT 2023
PRIMARY
CAS
54063-39-7
Created by admin on Fri Dec 15 16:21:23 GMT 2023 , Edited by admin on Fri Dec 15 16:21:23 GMT 2023
PRIMARY
EPA CompTox
DTXSID50866390
Created by admin on Fri Dec 15 16:21:23 GMT 2023 , Edited by admin on Fri Dec 15 16:21:23 GMT 2023
PRIMARY
INN
3464
Created by admin on Fri Dec 15 16:21:23 GMT 2023 , Edited by admin on Fri Dec 15 16:21:23 GMT 2023
PRIMARY
PUBCHEM
216214
Created by admin on Fri Dec 15 16:21:23 GMT 2023 , Edited by admin on Fri Dec 15 16:21:23 GMT 2023
PRIMARY
FDA UNII
9GXY5Z0873
Created by admin on Fri Dec 15 16:21:23 GMT 2023 , Edited by admin on Fri Dec 15 16:21:23 GMT 2023
PRIMARY
ChEMBL
CHEMBL2104222
Created by admin on Fri Dec 15 16:21:23 GMT 2023 , Edited by admin on Fri Dec 15 16:21:23 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY