IA-4 N-Oxide methanesulfonate

Molecular Formula: C₂₁H₂₆ClN₃O₅S₂

InChI: InChI=1/C20H22ClN3O2S.CH4O3S/c1-3-22(4-2)9-10-23-16-8-5-13(12-25)20-18(16)19(24(23)26)15-7-6-14(21)11-17(15)27-20;1-5(2,3)4/h5-8,11,25H,3-4,9-10,12H2,1-2H3;1H3,(H,2,3,4)/fC20H23ClN3O2S.CH3O3S/h22H;/q+1;-1

InChIKey: InChIKey=FCSYJLCVFKBMAO-PWMKEHDWCC
SMILES: CC[NH+](CC)CCN1C2=C3C(=C(C=C2)CO)SC4=C(C3=[N+]1[O-])C=CC(=C4)Cl.CS(=O)(=O)[O-]

Names:
    IA-4 N-Oxide methanesulfonate
    2H-(1)Benzothiopyrano(4,3,2-cd)indazole-5-methanol, 8-chloro-2-(2-(diethylamino)ethyl)-, N-oxide, monomethanesulfonate (salt)
    2H-(1)BENZOTHIOPYRANO(4,3,2-cd)INDAZOLE-5-METHANOL, 8-CHLORO-2-(2-(DIETHYLAMINO)
    60666-36-6

Registries:
    PubChem CID 43392
    PubChem ID 183811