Tocris-0685

Molecular Formula: C22H26N2O4S


InChI: InChI=1/C22H26N2O4S/c1-15(25)28-20-21(16-9-11-17(27-4)12-10-16)29-19-8-6-5-7-18(19)24(22(20)26)14-13-23(2)3/h5-12,20-21H,13-14H2,1-4H3/t20-,21+/m1/s1

InChIKey: InChIKey=HSUGRBWQSSZJOP-RTWAWAEBBV
SMILES: CC(=O)OC1C(SC2=CC=CC=C2N(C1=O)CCN(C)C)C3=CC=C(C=C3)OC

Names:
    NCGC00024309-02
    Tocris-0685
    [(4R,5R)-2-(2-dimethylaminoethyl)-5-(4-methoxyphenyl)-3-oxo-6-thia-2-azabicyclo[5.4.0]undeca-7,9,11-trien-4-yl] acetate

Registries:
    PubChem CID 39186
    PubChem ID 11113366