化学生物学

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  1. 马西替坦原料药杂质B
      规格或纯度 :
    • ≥98%
    CAS号 : 441798-25-0        Compound CID : 21041267
    分子式: C17H16Br2N6O4S        分子量: 557.93
    IUPAC Name: 5-(4-bromophenyl)-6-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-N-(methylsulfamoyl)pyrimidin-4-amine
    SMILES: CNS(=O)(=O)NC1=C(C(=NC=N1)OCCOC2=NC=C(C=N2)Br)C3=CC=C(C=C3)Br
    InChIKey: BRSITRUZDCGGKH-UHFFFAOYSA-N
    InChI: InChI=1S/C17H16Br2N6O4S/c1-20-30(26,27)25-15-14(11-2-4-12(18)5-3-11)16(24-10-23-15)28-6-7-29-17-21-8-13(19)9-22-17/h2-5,8-10,20H,6-7H2,1H3,(H,23,24,25)
  2. TPA-023B
      规格或纯度 :
    • ≥97%
    CAS号 : 425377-76-0        Compound CID : 9865233
    分子式: C21H15F2N5O        分子量: 391.382
    IUPAC Name: 3-fluoro-2-[2-fluoro-5-[3-(2-hydroxypropan-2-yl)imidazo[1,2-b][1,2,4]triazin-7-yl]phenyl]benzonitrile
    SMILES: CC(C)(C1=NC2=NC=C(N2N=C1)C3=CC(=C(C=C3)F)C4=C(C=CC=C4F)C#N)O
    InChIKey: PCZLQMGFNUNVOM-UHFFFAOYSA-N
    InChI: InChI=1S/C21H15F2N5O/c1-21(2,29)18-11-26-28-17(10-25-20(28)27-18)12-6-7-15(22)14(8-12)19-13(9-24)4-3-5-16(19)23/h3-8,10-11,29H,1-2H3
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