ZINC05121788

Molecular Formula: C₂₃H₂₈N₃O₃S⁺

InChI: InChI=1/C23H27N3O3S/c1-4-25(5-2)12-13-26(23-24-17-11-10-16(3)14-21(17)30-23)22(27)20-15-28-18-8-6-7-9-19(18)29-20/h6-11,14,20H,4-5,12-13,15H2,1-3H3/p+1/t20-/m0/s1/fC23H28N3O3S/h25H/q+1

InChIKey: InChIKey=JJDNEZKGWDDCLN-VMOOIVSJDC
SMILES: CC[NH+](CC)CCN(C1=NC2=C(S1)C=C(C=C2)C)C(=O)C3COC4=CC=CC=C4O3

Names:
    ZINC05121788
    2-[[(9S)-7,10-dioxabicyclo[4.4.0]deca-1,3,5-triene-9-carbonyl]-(6-methylbenzothiazol-2-yl)amino]ethyl-diethyl-azanium

Registries:
    PubChem CID 7511202
    PubChem ID 12786574