8-(azepan-1-yl)-7-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethyl]-1,3-dimethyl-purine-2,6-dione

Molecular Formula: C21H29N7O2S


InChI: InChI=1/C21H29N7O2S/c1-14-13-15(2)23-19(22-14)31-12-11-28-16-17(25(3)21(30)26(4)18(16)29)24-20(28)27-9-7-5-6-8-10-27/h13H,5-12H2,1-4H3

InChIKey: InChIKey=ZJRRSYOKPOZOGX-UHFFFAOYAE
SMILES: CC1=CC(=NC(=N1)SCCN2C3=C(N=C2N4CCCCCC4)N(C(=O)N(C3=O)C)C)C

Names:
    8-(azepan-1-yl)-7-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethyl]-1,3-dimethyl-purine-2,6-dione

Registries:
    PubChem CID 1091988
    PubChem ID 4854843