8-decylsulfanyl-1,3,7-trimethyl-purine-2,6-dione

Molecular Formula: C18H30N4O2S


InChI: InChI=1/C18H30N4O2S/c1-5-6-7-8-9-10-11-12-13-25-17-19-15-14(20(17)2)16(23)22(4)18(24)21(15)3/h5-13H2,1-4H3

InChIKey: InChIKey=BVEBFAGNKHKOOC-UHFFFAOYAV
SMILES: CCCCCCCCCCSC1=NC2=C(N1C)C(=O)N(C(=O)N2C)C

Names:
    Caffeine, 8- (decylthio)-
    NSC81489
    25837-26-7
    8-decylsulfanyl-1,3,7-trimethyl-purine-2,6-dione
    8-(Decylthio)caffeine

Registries:
    PubChem CID 33183
    PubChem ID 120596