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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H10N2O3
Molecular Weight 170.1659
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-Ethyl-5-methylbarbituric acid

SMILES

CCC1(C)C(=O)NC(=O)NC1=O

InChI

InChIKey=RCFRTWDBBMGLGK-UHFFFAOYSA-N
InChI=1S/C7H10N2O3/c1-3-7(2)4(10)8-6(12)9-5(7)11/h3H2,1-2H3,(H2,8,9,10,11,12)

HIDE SMILES / InChI

Molecular Formula C7H10N2O3
Molecular Weight 170.1659
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 12:22:07 GMT 2023
Edited
by admin
on Sat Dec 16 12:22:07 GMT 2023
Record UNII
3LBZ95F292
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-Ethyl-5-methylbarbituric acid
Systematic Name English
NSC-30403
Code English
5-Methyl-5-ethylbarbituric acid
Systematic Name English
2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-5-methyl-
Systematic Name English
5-Ethyl-5-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione
Systematic Name English
Barbituric acid, 5-ethyl-5-methyl-
Systematic Name English
5-Ethyl-5-methyl-1H,3H,5H-pyrimidin-2,4,6-trione
Systematic Name English
Code System Code Type Description
CAS
27653-63-0
Created by admin on Sat Dec 16 12:22:07 GMT 2023 , Edited by admin on Sat Dec 16 12:22:07 GMT 2023
PRIMARY
NSC
30403
Created by admin on Sat Dec 16 12:22:07 GMT 2023 , Edited by admin on Sat Dec 16 12:22:07 GMT 2023
PRIMARY
ECHA (EC/EINECS)
248-593-7
Created by admin on Sat Dec 16 12:22:07 GMT 2023 , Edited by admin on Sat Dec 16 12:22:07 GMT 2023
PRIMARY
FDA UNII
3LBZ95F292
Created by admin on Sat Dec 16 12:22:07 GMT 2023 , Edited by admin on Sat Dec 16 12:22:07 GMT 2023
PRIMARY
PUBCHEM
95705
Created by admin on Sat Dec 16 12:22:07 GMT 2023 , Edited by admin on Sat Dec 16 12:22:07 GMT 2023
PRIMARY
EPA CompTox
DTXSID00182032
Created by admin on Sat Dec 16 12:22:07 GMT 2023 , Edited by admin on Sat Dec 16 12:22:07 GMT 2023
PRIMARY