6-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-7H-purine

Molecular Formula: C12H6F3N5O2S


InChI: InChI=1/C12H6F3N5O2S/c13-12(14,15)6-1-2-8(7(3-6)20(21)22)23-11-9-10(17-4-16-9)18-5-19-11/h1-5H,(H,16,17,18,19)/f/h16H

InChIKey: InChIKey=RVSKYPFPZQREND-WYUMXYHSCC
SMILES: C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])SC2=NC=NC3=C2NC=N3

Names:
    6-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-7H-purine

Registries:
    PubChem CID 754678
    PubChem ID 4817491