azathioprine

[1. A derivative of 6-mercaptopurine, used as a cytotoxic and immunosuppressive agent.

Molecular Formula: C₉H₇N₇O₂S

InChI: InChI=1/C9H7N7O2S/c1-15-4-14-7(16(17)18)9(15)19-8-5-6(11-2-10-5)12-3-13-8/h2-4H,1H3,(H,10,11,12,13)/f/h10H

InChIKey: InChIKey=LMEKQMALGUDUQG-KZFATGLACK
SMILES: Cn1cnc(c1Sc2ncnc3nc[nH]c23)[N+]([O-])=O

CAS number 446-86-6

Names:
    Azathioprine (JP15/USP)
    azathioprine
    Imuran (TN)
    SPBio_001987
    6-((1-Methyl-4-nitro-1H-imidazol-5-yl)thio)-1H-purine
    6-(1'-Methyl-4'-nitro-5'-imidazolyl)-mercaptopurine
    6-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-7H-purine

Registries:
    PubChem CID 2265
    CAS 446-86-6 (from NIST)
    ChEBI 2948
    Kegg D00238
    PubChem ID 11485723
    PubChem ID 7847305