9-(Propargyloxymethyl) azathoprine

Molecular Formula: C13H11N7O3S


InChI: InChI=1/C13H11N7O3S/c1-3-4-23-8-19-7-16-9-10(19)14-5-15-12(9)24-13-11(20(21)22)17-6-18(13)2/h1,5-7H,4,8H2,2H3

InChIKey: InChIKey=VCISZBHTRAJTOY-UHFFFAOYAN
SMILES: CN1C=NC(=C1SC2=NC=NC3=C2N=CN3COCC#C)[N+](=O)[O-]

Names:
    AIDS-134807
    AIDS134807
    NSC633668
    6-((4-(Hydroxy(oxido)amino)-1-methyl-1H-imidazol-5-yl)thio)-9-((2-propynyloxy)methyl)-9H-purine
    6-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-9-(prop-2-ynoxymethyl)purine
    9-(Propargyloxymethyl) azathoprine

Registries:
    PubChem CID 365727
    PubChem ID 230756