8-benzothiazol-2-ylsulfanyl-3-methyl-7-octyl-purine-2,6-dione

Molecular Formula: C21H25N5O2S2


InChI: InChI=1/C21H25N5O2S2/c1-3-4-5-6-7-10-13-26-16-17(25(2)19(28)24-18(16)27)23-20(26)30-21-22-14-11-8-9-12-15(14)29-21/h8-9,11-12H,3-7,10,13H2,1-2H3,(H,24,27,28)/f/h24H

InChIKey: InChIKey=SLNOUDUMSAHRHT-LQFNOIFHCN
SMILES: CCCCCCCCN1C2=C(N=C1SC3=NC4=CC=CC=C4S3)N(C(=O)NC2=O)C

Names:
    8-benzothiazol-2-ylsulfanyl-3-methyl-7-octyl-purine-2,6-dione

Registries:
    PubChem CID 3101172
    PubChem ID 4791556