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Details

Stereochemistry ACHIRAL
Molecular Formula C9H12N4O2
Molecular Weight 208.2172
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-METHYL-3-PROPYL-7H-PURINE-2,6-DIONE

SMILES

CCCN1C2=C(NC=N2)C(=O)N(C)C1=O

InChI

InChIKey=MCPROACZLSAAPY-UHFFFAOYSA-N
InChI=1S/C9H12N4O2/c1-3-4-13-7-6(10-5-11-7)8(14)12(2)9(13)15/h5H,3-4H2,1-2H3,(H,10,11)

HIDE SMILES / InChI

Approval Year

Name Type Language
1-METHYL-3-PROPYL-7H-PURINE-2,6-DIONE
Systematic Name English
1-METHYL-3-N-PROPYLXANTHINE
Preferred Name English
1H-PURINE-2,6-DIONE, 3,9-DIHYDRO-1-METHYL-3-PROPYL-
Systematic Name English
3,9-DIHYDRO-1-METHYL-3-PROPYL-1H-PURINE-2,6-DIONE
Systematic Name English
Code System Code Type Description
CAS
118024-67-2
Created by admin on Wed Apr 02 06:44:05 GMT 2025 , Edited by admin on Wed Apr 02 06:44:05 GMT 2025
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PUBCHEM
86344
Created by admin on Wed Apr 02 06:44:05 GMT 2025 , Edited by admin on Wed Apr 02 06:44:05 GMT 2025
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CHEBI
145517
Created by admin on Wed Apr 02 06:44:05 GMT 2025 , Edited by admin on Wed Apr 02 06:44:05 GMT 2025
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FDA UNII
DWZ57272FA
Created by admin on Wed Apr 02 06:44:05 GMT 2025 , Edited by admin on Wed Apr 02 06:44:05 GMT 2025
PRIMARY
EPA CompTox
DTXSID10879542
Created by admin on Wed Apr 02 06:44:05 GMT 2025 , Edited by admin on Wed Apr 02 06:44:05 GMT 2025
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