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  1. 沃替西汀
    CAS号 : 508233-74-7        Compound CID : 9966051
    分子式: C18H22N2S        分子量: 298.45
    IUPAC Name: 1-[2-(2,4-dimethylphenyl)sulfanylphenyl]piperazine
    SMILES: CC1=CC(=C(C=C1)SC2=CC=CC=C2N3CCNCC3)C
    InChIKey: YQNWZWMKLDQSAC-UHFFFAOYSA-N
    InChI: InChI=1S/C18H22N2S/c1-14-7-8-17(15(2)13-14)21-18-6-4-3-5-16(18)20-11-9-19-10-12-20/h3-8,13,19H,9-12H2,1-2H3
  2. LY2801653,抑制Met (c-Met)酪氨酸激酶
    CAS号 : 1206799-15-6        Compound CID : 44603533
    分子式: C30H22F2N6O3        分子量: 552.53
    IUPAC Name: N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-6-methyl-2-oxopyridine-3-carboxamide
    SMILES: CC1=CC=C(C(=O)N1C2=CC=C(C=C2)F)C(=O)NC3=CC(=C(C=C3)OC4=C(C=C5C(=C4)C=NN5C)C6=CNN=C6)F
    InChIKey: QHADVLVFMKEIIP-UHFFFAOYSA-N
    InChI: InChI=1S/C30H22F2N6O3/c1-17-3-9-23(30(40)38(17)22-7-4-20(31)5-8-22)29(39)36-21-6-10-27(25(32)12-21)41-28-11-18-16-35-37(2)26(18)13-24(28)19-14-33-34-15-19/h3-16H,1-2H3,(H,33,34)(H,36,39)
  3. LY2801653
    CAS号 : 1206799-15-6        Compound CID : 44603533
    分子式: C30H22F2N6O3        分子量: 552.53
    IUPAC Name: N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-6-methyl-2-oxopyridine-3-carboxamide
    SMILES: CC1=CC=C(C(=O)N1C2=CC=C(C=C2)F)C(=O)NC3=CC(=C(C=C3)OC4=C(C=C5C(=C4)C=NN5C)C6=CNN=C6)F
    InChIKey: QHADVLVFMKEIIP-UHFFFAOYSA-N
    InChI: InChI=1S/C30H22F2N6O3/c1-17-3-9-23(30(40)38(17)22-7-4-20(31)5-8-22)29(39)36-21-6-10-27(25(32)12-21)41-28-11-18-16-35-37(2)26(18)13-24(28)19-14-33-34-15-19/h3-16H,1-2H3,(H,33,34)(H,36,39)
  4. Vortioxetine
    CAS号 : 508233-74-7        Compound CID : 9966051
    分子式: C18H22N2S        分子量: 298.45
    IUPAC Name: 1-[2-(2,4-dimethylphenyl)sulfanylphenyl]piperazine
    SMILES: CC1=CC(=C(C=C1)SC2=CC=CC=C2N3CCNCC3)C
    InChIKey: YQNWZWMKLDQSAC-UHFFFAOYSA-N
    InChI: InChI=1S/C18H22N2S/c1-14-7-8-17(15(2)13-14)21-18-6-4-3-5-16(18)20-11-9-19-10-12-20/h3-8,13,19H,9-12H2,1-2H3
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