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

Details

Stereochemistry ACHIRAL
Molecular Formula C17H20N4O4
Molecular Weight 344.3651
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 8-(3,4-dimethoxyphenyl)-1,3-diethyl-1H-purine-2,6(3H,7H)-dione

SMILES

CCN1C2=C(NC(=N2)C3=CC=C(OC)C(OC)=C3)C(=O)N(CC)C1=O

InChI

InChIKey=ORNXQOYFRGPMGI-UHFFFAOYSA-N
InChI=1S/C17H20N4O4/c1-5-20-15-13(16(22)21(6-2)17(20)23)18-14(19-15)10-7-8-11(24-3)12(9-10)25-4/h7-9H,5-6H2,1-4H3,(H,18,19)

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
8-(3,4-dimethoxyphenyl)-1,3-diethyl-1H-purine-2,6(3H,7H)-dione
Systematic Name English
1H-Purine-2,6-dione, 8-(3,4-dimethoxyphenyl)-1,3-diethyl-3,9-dihydro-
Preferred Name English
8-(3,4-Dimethoxyphenyl)-1,3-diethyl-3,9-dihydro-1H-purine-2,6-dione
Systematic Name English
Code System Code Type Description
FDA UNII
LAL42ENV5N
Created by admin on Wed Apr 02 20:23:04 GMT 2025 , Edited by admin on Wed Apr 02 20:23:04 GMT 2025
PRIMARY
PUBCHEM
171390222
Created by admin on Wed Apr 02 20:23:04 GMT 2025 , Edited by admin on Wed Apr 02 20:23:04 GMT 2025
PRIMARY
CAS
1048955-45-8
Created by admin on Wed Apr 02 20:23:04 GMT 2025 , Edited by admin on Wed Apr 02 20:23:04 GMT 2025
PRIMARY
NIH
NCATS
PRIVACY NOTICE
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966