小分子和化合物库

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  1. SL-327,MEK抑制剂
      规格或纯度 :
    • Moligand™
    • ≥98%
    • mixture of isomers
    CAS号 : 305350-87-2        Compound CID : 9549284
    分子式: C16H12F3N3S        分子量: 335.35
    IUPAC Name: (Z)-3-amino-3-(4-aminophenyl)sulfanyl-2-[2-(trifluoromethyl)phenyl]prop-2-enenitrile
    SMILES: C1=CC=C(C(=C1)C(=C(N)SC2=CC=C(C=C2)N)C#N)C(F)(F)F
    InChIKey: JLOXTZFYJNCPIS-FYWRMAATSA-N
    InChI: InChI=1S/C16H12F3N3S/c17-16(18,19)14-4-2-1-3-12(14)13(9-20)15(22)23-11-7-5-10(21)6-8-11/h1-8H,21-22H2/b15-13+
  2. BAY 869766
    CAS号 : 923032-37-5        Compound CID : 44182295
    分子式: C19H20F3IN2O5S        分子量: 572.34
    IUPAC Name: N-[3,4-difluoro-2-(2-fluoro-4-iodoanilino)-6-methoxyphenyl]-1-[(2S)-2,3-dihydroxypropyl]cyclopropane-1-sulfonamide
    SMILES: COC1=CC(=C(C(=C1NS(=O)(=O)C2(CC2)CC(CO)O)NC3=C(C=C(C=C3)I)F)F)F
    InChIKey: RDSACQWTXKSHJT-NSHDSACASA-N
    InChI: InChI=1S/C19H20F3IN2O5S/c1-30-15-7-13(21)16(22)18(24-14-3-2-10(23)6-12(14)20)17(15)25-31(28,29)19(4-5-19)8-11(27)9-26/h2-3,6-7,11,24-27H,4-5,8-9H2,1H3/t11-/m0/s1
  3. AZD8330,变构MEK抑制剂
    CAS号 : 869357-68-6        Compound CID : 16666708
    分子式: C16H17FIN3O4        分子量: 461.23
    IUPAC Name: 2-(2-fluoro-4-iodoanilino)-N-(2-hydroxyethoxy)-1,5-dimethyl-6-oxopyridine-3-carboxamide
    SMILES: CC1=CC(=C(N(C1=O)C)NC2=C(C=C(C=C2)I)F)C(=O)NOCCO
    InChIKey: RWEVIPRMPFNTLO-UHFFFAOYSA-N
    InChI: InChI=1S/C16H17FIN3O4/c1-9-7-11(15(23)20-25-6-5-22)14(21(2)16(9)24)19-13-4-3-10(18)8-12(13)17/h3-4,7-8,19,22H,5-6H2,1-2H3,(H,20,23)
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