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Details

Stereochemistry ACHIRAL
Molecular Formula C11H14N4O2
Molecular Weight 234.2545
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 8-CYCLOBUTYLTHEOPHYLLINE

SMILES

CN1C2=C(N=C(N2)C3CCC3)C(=O)N(C)C1=O

InChI

InChIKey=OBURDMXZDVFAKK-UHFFFAOYSA-N
InChI=1S/C11H14N4O2/c1-14-9-7(10(16)15(2)11(14)17)12-8(13-9)6-4-3-5-6/h6H,3-5H2,1-2H3,(H,12,13)

HIDE SMILES / InChI

Molecular Formula C11H14N4O2
Molecular Weight 234.2545
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 13:10:32 GMT 2023
Edited
by admin
on Sat Dec 16 13:10:32 GMT 2023
Record UNII
2DCS7ZK0QZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
8-CYCLOBUTYLTHEOPHYLLINE
Systematic Name English
8-CYCLOBUTYL-3,9-DIHYDRO-1,3-DIMETHYL-1H-PURINE-2,6-DIONE
Systematic Name English
NSC-101798
Code English
1H-PURINE-2,6-DIONE, 8-CYCLOBUTYL-3,9-DIHYDRO-1,3-DIMETHYL-
Systematic Name English
1H-PURINE-2,6-DIONE, 8-CYCLOBUTYL-3,4-DIHYDRO-1,3-DIMETHYL-
Systematic Name English
1H-PURINE-2,6-DIONE, 8-CYCLOBUTYL-3,7-DIHYDRO-1,3-DIMETHYL-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID10189431
Created by admin on Sat Dec 16 13:10:32 GMT 2023 , Edited by admin on Sat Dec 16 13:10:32 GMT 2023
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NSC
101798
Created by admin on Sat Dec 16 13:10:32 GMT 2023 , Edited by admin on Sat Dec 16 13:10:32 GMT 2023
PRIMARY
FDA UNII
2DCS7ZK0QZ
Created by admin on Sat Dec 16 13:10:32 GMT 2023 , Edited by admin on Sat Dec 16 13:10:32 GMT 2023
PRIMARY
CAS
35873-48-4
Created by admin on Sat Dec 16 13:10:32 GMT 2023 , Edited by admin on Sat Dec 16 13:10:32 GMT 2023
PRIMARY
PUBCHEM
97136
Created by admin on Sat Dec 16 13:10:32 GMT 2023 , Edited by admin on Sat Dec 16 13:10:32 GMT 2023
PRIMARY