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  1. 异丁司特
    CAS号 : 50847-11-5       
    分子式: C14H18N2O        分子量: 230.31
    IUPAC Name: 2-methyl-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-1-one
    SMILES: CC(C)C1=NN2C=CC=CC2=C1C(=O)C(C)C
    InChIKey: ZJVFLBOZORBYFE-UHFFFAOYSA-N
    InChI: InChI=1S/C14H18N2O/c1-9(2)13-12(14(17)10(3)4)11-7-5-6-8-16(11)15-13/h5-10H,1-4H3
  2. Selexipag
    CAS号 : 475086-01-2        Compound CID : 9913767
    分子式: C26H32N4O4S        分子量: 496.62
    IUPAC Name: 2-[4-[(5,6-diphenylpyrazin-2-yl)-propan-2-ylamino]butoxy]-N-methylsulfonylacetamide
    SMILES: CC(C)N(CCCCOCC(=O)NS(=O)(=O)C)C1=CN=C(C(=N1)C2=CC=CC=C2)C3=CC=CC=C3
    InChIKey: QXWZQTURMXZVHJ-UHFFFAOYSA-N
    InChI: InChI=1S/C26H32N4O4S/c1-20(2)30(16-10-11-17-34-19-24(31)29-35(3,32)33)23-18-27-25(21-12-6-4-7-13-21)26(28-23)22-14-8-5-9-15-22/h4-9,12-15,18,20H,10-11,16-17,19H2,1-3H3,(H,29,31)
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