Identification
Name |
8-Cyclopentylsulfanyl-1,3-Dimethyl-7H-Purine-2,6-Dione |
Synonyms |
8-(Cyclopentylthio)-1,3-Dimethyl-7H-Purine-2,6-Dione; 8-(Cyclopentylthio)-1,3-Dimethyl-7H-Purine-2,6-Quinone; 8-Cyclopentylthiotheophylline |
|
Molecular Structure |
 |
Molecular Formula |
C12H16N4O2S |
Molecular Weight |
280.34 |
CAS Registry Number |
74039-72-8 |
SMILES |
CN3C1=C([NH]C(=N1)SC2CCCC2)C(N(C3=O)C)=O |
InChI |
1S/C12H16N4O2S/c1-15-9-8(10(17)16(2)12(15)18)13-11(14-9)19-7-5-3-4-6-7/h7H,3-6H2,1-2H3,(H,13,14) |
InChIKey |
MEMVDDHMDYKKGA-UHFFFAOYSA-N |
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