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

Details

Stereochemistry RACEMIC
Molecular Formula C13H15N3O3
Molecular Weight 261.2765
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-(P-AMINOPHENYL)-5-ETHYL-1-METHYLBARBITURIC ACID

SMILES

CCC1(C(=O)NC(=O)N(C)C1=O)C2=CC=C(N)C=C2

InChI

InChIKey=HJQDNWSIHPKTLV-UHFFFAOYSA-N
InChI=1S/C13H15N3O3/c1-3-13(8-4-6-9(14)7-5-8)10(17)15-12(19)16(2)11(13)18/h4-7H,3,14H2,1-2H3,(H,15,17,19)

HIDE SMILES / InChI

Molecular Formula C13H15N3O3
Molecular Weight 261.2765
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:01:16 GMT 2023
Edited
by admin
on Sat Dec 16 11:01:16 GMT 2023
Record UNII
0WPF5Z4IJ9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-(P-AMINOPHENYL)-5-ETHYL-1-METHYLBARBITURIC ACID
Common Name English
2,4,6(1H,3H,5H)-PYRIMIDINETRIONE, 5-(4-AMINOPHENYL)-5-ETHYL-1-METHYL
Systematic Name English
Code System Code Type Description
PUBCHEM
46486
Created by admin on Sat Dec 16 11:01:16 GMT 2023 , Edited by admin on Sat Dec 16 11:01:16 GMT 2023
PRIMARY
EPA CompTox
DTXSID80982057
Created by admin on Sat Dec 16 11:01:16 GMT 2023 , Edited by admin on Sat Dec 16 11:01:16 GMT 2023
PRIMARY
FDA UNII
0WPF5Z4IJ9
Created by admin on Sat Dec 16 11:01:16 GMT 2023 , Edited by admin on Sat Dec 16 11:01:16 GMT 2023
PRIMARY
CAS
64038-09-1
Created by admin on Sat Dec 16 11:01:16 GMT 2023 , Edited by admin on Sat Dec 16 11:01:16 GMT 2023
PRIMARY