IA-3 N-oxide methanesulfonate

Molecular Formula: C₂₁H₂₆ClN₃O₄S₂

InChI: InChI=1/C20H22ClN3OS.CH4O3S/c1-4-22(5-2)10-11-23-16-9-6-13(3)20-18(16)19(24(23)25)15-8-7-14(21)12-17(15)26-20;1-5(2,3)4/h6-9,12H,4-5,10-11H2,1-3H3;1H3,(H,2,3,4)/fC20H23ClN3OS.CH3O3S/h22H;/q+1;-1

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

Names:
    IA-3 N-oxide methanesulfonate
    2H-(1)Benzothiopyrano(4,3,2-cd)indazole-2-ethanamine, 8-chloro-N,N-diethyl-5-methyl-, N-oxide,monomethanesulfonate
    2H-(1)BENZOTHIOPYRANO(4,3,2-cd)INDAZOLE-2-ETHANAMINE, 8-CHLORO-N,N-DIETHYL-5-MET
    60666-35-5

Registries:
    PubChem CID 43391
    PubChem ID 183810