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

Details

Stereochemistry ACHIRAL
Molecular Formula C12H11BrN2O3
Molecular Weight 311.131
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BROPHEBARBITAL

SMILES

CCC1(C(=O)NC(=O)NC1=O)C2=CC(Br)=CC=C2

InChI

InChIKey=DFTKCGKSDZVCTO-UHFFFAOYSA-N
InChI=1S/C12H11BrN2O3/c1-2-12(7-4-3-5-8(13)6-7)9(16)14-11(18)15-10(12)17/h3-6H,2H2,1H3,(H2,14,15,16,17,18)

HIDE SMILES / InChI

Molecular Formula C12H11BrN2O3
Molecular Weight 311.131
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:36:53 GMT 2023
Edited
by admin
on Sat Dec 16 11:36:53 GMT 2023
Record UNII
LAD0UT1E4E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BROPHEBARBITAL
Common Name English
BARBITURIC ACID, 5-(M-BROMOPHENYL)-5-ETHYL-
Systematic Name English
2,4,6(1H,3H,5H)-PYRIMIDINETRIONE, 5-(3-BROMOPHENYL)-5-ETHYL-
Systematic Name English
MURENAL 9
Common Name English
5-(M-BROMOPHENYL)-5-ETHYLBARBITURIC ACID
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID50726647
Created by admin on Sat Dec 16 11:36:53 GMT 2023 , Edited by admin on Sat Dec 16 11:36:53 GMT 2023
PRIMARY
FDA UNII
LAD0UT1E4E
Created by admin on Sat Dec 16 11:36:53 GMT 2023 , Edited by admin on Sat Dec 16 11:36:53 GMT 2023
PRIMARY
CAS
3865-10-9
Created by admin on Sat Dec 16 11:36:53 GMT 2023 , Edited by admin on Sat Dec 16 11:36:53 GMT 2023
PRIMARY
PUBCHEM
57458865
Created by admin on Sat Dec 16 11:36:53 GMT 2023 , Edited by admin on Sat Dec 16 11:36:53 GMT 2023
PRIMARY
WIKIPEDIA
Brophebarbital
Created by admin on Sat Dec 16 11:36:53 GMT 2023 , Edited by admin on Sat Dec 16 11:36:53 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY