8-(2-hydroxyethylsulfanyl)-1,3,7-trimethyl-purine-2,6-dione

Molecular Formula: C10H14N4O3S


InChI: InChI=1/C10H14N4O3S/c1-12-6-7(11-9(12)18-5-4-15)13(2)10(17)14(3)8(6)16/h15H,4-5H2,1-3H3

InChIKey: InChIKey=REVYYWXIURTZMT-UHFFFAOYAE
SMILES: CN1C2=C(N=C1SCCO)N(C(=O)N(C2=O)C)C

Names:
    BRN 0385021
    CAFFEINE, 8-((2-HYDROXYETHYL)THIO)-
    114864-92-5
    4-26-00-02735 (Beilstein Handbook Reference)
    8-((2-Hydroxyethyl)thio)caffeine
    8-(2-hydroxyethylsulfanyl)-1,3,7-trimethyl-purine-2,6-dione

Registries:
    PubChem CID 41792
    PubChem ID 196917