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  1. LIT-927
    CAS号 : 2172879-52-4        Compound CID : 137287575
    分子式: C17H13ClN2O3        分子量: 328.75
    IUPAC Name: 6-(4-chlorophenyl)-4-(4-hydroxy-3-methoxyphenyl)-1H-pyrimidin-2-one
    SMILES: COC1=C(C=CC(=C1)C2=NC(=O)NC(=C2)C3=CC=C(C=C3)Cl)O
    InChIKey: BYYRNPIGDRRGLJ-UHFFFAOYSA-N
    InChI: InChI=1S/C17H13ClN2O3/c1-23-16-8-11(4-7-15(16)21)14-9-13(19-17(22)20-14)10-2-5-12(18)6-3-10/h2-9,21H,1H3,(H,19,20,22)
  2. 特非那定
    CAS号 : 50679-08-8        Compound CID : 5405
    分子式: C32H41NO2        分子量: 471.67
    IUPAC Name: 1-(4-tert-butylphenyl)-4-[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]butan-1-ol
    SMILES: CC(C)(C)C1=CC=C(C=C1)C(CCCN2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)O
    InChIKey: GUGOEEXESWIERI-UHFFFAOYSA-N
    InChI: InChI=1S/C32H41NO2/c1-31(2,3)26-18-16-25(17-19-26)30(34)15-10-22-33-23-20-29(21-24-33)32(35,27-11-6-4-7-12-27)28-13-8-5-9-14-28/h4-9,11-14,16-19,29-30,34-35H,10,15,20-24H2,1-3H3
  3. LIT-927
    CAS号 : 2172879-52-4        Compound CID : 137287575
    分子式: C17H13ClN2O3        分子量: 328.75
    IUPAC Name: 6-(4-chlorophenyl)-4-(4-hydroxy-3-methoxyphenyl)-1H-pyrimidin-2-one
    SMILES: COC1=C(C=CC(=C1)C2=NC(=O)NC(=C2)C3=CC=C(C=C3)Cl)O
    InChIKey: BYYRNPIGDRRGLJ-UHFFFAOYSA-N
    InChI: InChI=1S/C17H13ClN2O3/c1-23-16-8-11(4-7-15(16)21)14-9-13(19-17(22)20-14)10-2-5-12(18)6-3-10/h2-9,21H,1H3,(H,19,20,22)
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