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

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 7-ETHYLTHEOPHYLLINE

SMILES

CCN1C=NC2=C1C(=O)N(C)C(=O)N2C

InChI

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

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

TitleDatePubMed
Stability studies of selected doping agents in urine: caffeine.
2003 Oct 5
Patents
Name Type Language
7-ETHYLTHEOPHYLLINE
Systematic Name English
THEOPHYLLINE, 7-ETHYL-
Systematic Name English
ETHYLTHEOPHYLLINE [VAN]
Common Name English
7-ETHYL-1,3-DIMETHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE
Systematic Name English
NSC-515485
Code English
ETHYLTHEOPHYLLINE
VAN  
Systematic Name English
1H-PURINE-2,6-DIONE, 7-ETHYL-3,7-DIHYDRO-1,3-DIMETHYL-
Systematic Name English
Code System Code Type Description
FDA UNII
4EZ53T6D01
Created by admin on Fri Dec 15 18:32:47 GMT 2023 , Edited by admin on Fri Dec 15 18:32:47 GMT 2023
PRIMARY
NSC
515485
Created by admin on Fri Dec 15 18:32:47 GMT 2023 , Edited by admin on Fri Dec 15 18:32:47 GMT 2023
PRIMARY
EPA CompTox
DTXSID00177605
Created by admin on Fri Dec 15 18:32:47 GMT 2023 , Edited by admin on Fri Dec 15 18:32:47 GMT 2023
PRIMARY
CAS
23043-88-1
Created by admin on Fri Dec 15 18:32:47 GMT 2023 , Edited by admin on Fri Dec 15 18:32:47 GMT 2023
PRIMARY
PUBCHEM
89976
Created by admin on Fri Dec 15 18:32:47 GMT 2023 , Edited by admin on Fri Dec 15 18:32:47 GMT 2023
PRIMARY