NSC47781

Molecular Formula: C₁₃H₁₆N₈O₂S

InChI: InChI=1/C13H16N8O2S/c1-3-4-5-20-7-15-8-9(20)17-13(14)18-11(8)24-12-10(21(22)23)16-6-19(12)2/h6-7H,3-5H2,1-2H3,(H2,14,17,18)/f/h14H2

InChIKey: InChIKey=MPGCNJUSMWDEDV-YGPBECBDCZ
SMILES: CCCCN1C=NC2=C1N=C(N=C2SC3=C(N=CN3C)[N+](=O)[O-])N

Names:
    NSC47781
    36892-45-2
    9-butyl-6-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-purin-2-amine

Registries:
    PubChem CID 240891
    PubChem ID 100585