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

Details

Stereochemistry ACHIRAL
Molecular Formula C13H14N2O3
Molecular Weight 246.2619
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-BENZYL-1,3-DIMETHYLBARBITURIC ACID

SMILES

CN1C(=O)C(CC2=CC=CC=C2)C(=O)N(C)C1=O

InChI

InChIKey=JOBKZALYQYGIAA-UHFFFAOYSA-N
InChI=1S/C13H14N2O3/c1-14-11(16)10(12(17)15(2)13(14)18)8-9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3

HIDE SMILES / InChI

Approval Year

Name Type Language
5-BENZYL-1,3-DIMETHYLBARBITURIC ACID
Systematic Name English
NSC-120879
Preferred Name English
2,4,6(1H,3H,5H)-PYRIMIDINETRIONE, 1,3-DIMETHYL-5-(PHENYLMETHYL)-
Systematic Name English
BARBITURIC ACID, 5-BENZYL-1,3-DIMETHYL-
Systematic Name English
Code System Code Type Description
PUBCHEM
27002
Created by admin on Tue Apr 01 19:44:25 GMT 2025 , Edited by admin on Tue Apr 01 19:44:25 GMT 2025
PRIMARY
CAS
15018-52-7
Created by admin on Tue Apr 01 19:44:25 GMT 2025 , Edited by admin on Tue Apr 01 19:44:25 GMT 2025
PRIMARY
EPA CompTox
DTXSID50164484
Created by admin on Tue Apr 01 19:44:25 GMT 2025 , Edited by admin on Tue Apr 01 19:44:25 GMT 2025
PRIMARY
NSC
120879
Created by admin on Tue Apr 01 19:44:25 GMT 2025 , Edited by admin on Tue Apr 01 19:44:25 GMT 2025
PRIMARY
FDA UNII
RU5F9H5XHE
Created by admin on Tue Apr 01 19:44:25 GMT 2025 , Edited by admin on Tue Apr 01 19:44:25 GMT 2025
PRIMARY