0 B28R3.506702367 CCOC(=O)c1c[n]c(cc1)C#Cc2cc3c(cc2)S(=O)CCC3(C)C Amb24095623 [0,1,0,0,0,0|0,0,1]=2 1 B29R3.4968084083 [2H]C1([2H])CC(C)(C)c2cc(ccc2S1)[13C]#[13C]c3ccc(c[n]3)C(=O)OCC Amb22057428 [0,2,0,0,0,0|0,0,0]=2