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  1. 齐留通(Zileuton)
    CAS号 : 111406-87-2        Compound CID : 60490
    分子式: C11H12N2O2S        分子量: 236.29
    IUPAC Name: 1-[1-(1-benzothiophen-2-yl)ethyl]-1-hydroxyurea
    SMILES: CC(C1=CC2=CC=CC=C2S1)N(C(=O)N)O
    InChIKey: MWLSOWXNZPKENC-UHFFFAOYSA-N
    InChI: InChI=1S/C11H12N2O2S/c1-7(13(15)11(12)14)10-6-8-4-2-3-5-9(8)16-10/h2-7,15H,1H3,(H2,12,14)
  2. LYS-006
    CAS号 : 1799681-85-8        Compound CID : 118166560
    分子式: C16H14ClFN6O3        分子量: 392.77
    IUPAC Name: (3S)-3-amino-4-[5-[4-(5-chloro-3-fluoropyridin-2-yl)oxyphenyl]tetrazol-2-yl]butanoic acid
    SMILES: C1=CC(=CC=C1C2=NN(N=N2)CC(CC(=O)O)N)OC3=C(C=C(C=N3)Cl)F
    InChIKey: ZEGMEJVULDALSH-NSHDSACASA-N
    InChI: InChI=1S/C16H14ClFN6O3/c17-10-5-13(18)16(20-7-10)27-12-3-1-9(2-4-12)15-21-23-24(22-15)8-11(19)6-14(25)26/h1-5,7,11H,6,8,19H2,(H,25,26)/t11-/m0/s1
  3. BAY-985
    CAS号 : 2409479-29-2        Compound CID : 145925685
    分子式: C27H30F3N9O        分子量: 553.58
    IUPAC Name: 1-[4-[(1R)-1-[2-[[6-[6-(dimethylamino)pyrimidin-4-yl]-1H-benzimidazol-2-yl]amino]pyridin-4-yl]ethyl]piperazin-1-yl]-3,3,3-trifluoropropan-1-one
    SMILES: CC(C1=CC(=NC=C1)NC2=NC3=C(N2)C=C(C=C3)C4=CC(=NC=N4)N(C)C)N5CCN(CC5)C(=O)CC(F)(F)F
    InChIKey: HZRJHVDNTDBTOZ-QGZVFWFLSA-N
    InChI: InChI=1S/C27H30F3N9O/c1-17(38-8-10-39(11-9-38)25(40)15-27(28,29)30)18-6-7-31-23(13-18)36-26-34-20-5-4-19(12-22(20)35-26)21-14-24(37(2)3)33-16-32-21/h4-7,12-14,16-17H,8-11,15H2,1-3H3,(H2,31,34,35,36)/t17-/m1/s1
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