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  1. AM 095
    CAS号 : 1228690-36-5       
    分子式: C27H24N2O5        分子量: 456.49
    IUPAC Name: 2-[4-[4-[3-methyl-4-[[(1R)-1-phenylethoxy]carbonylamino]-1,2-oxazol-5-yl]phenyl]phenyl]acetic acid
    SMILES: CC1=NOC(=C1NC(=O)OC(C)C2=CC=CC=C2)C3=CC=C(C=C3)C4=CC=C(C=C4)CC(=O)O
    InChIKey: LNDDRUPAICPXIN-GOSISDBHSA-N
    InChI: InChI=1S/C27H24N2O5/c1-17-25(28-27(32)33-18(2)20-6-4-3-5-7-20)26(34-29-17)23-14-12-22(13-15-23)21-10-8-19(9-11-21)16-24(30)31/h3-15,18H,16H2,1-2H3,(H,28,32)(H,30,31)/t18-/m1/s1
  2. 阿莫沙平
    CAS号 : 14028-44-5       
    分子式: C17H16ClN3O        分子量: 313.78
    IUPAC Name: 8-chloro-6-piperazin-1-ylbenzo[b][1,4]benzoxazepine
    SMILES: C1CN(CCN1)C2=NC3=CC=CC=C3OC4=C2C=C(C=C4)Cl
    InChIKey: QWGDMFLQWFTERH-UHFFFAOYSA-N
    InChI: InChI=1S/C17H16ClN3O/c18-12-5-6-15-13(11-12)17(21-9-7-19-8-10-21)20-14-3-1-2-4-16(14)22-15/h1-6,11,19H,7-10H2
  3. BMS-986020
    CAS号 : 1257213-50-5       
    分子式: C29H26N2O5        分子量: 482.53
    IUPAC Name: 1-[4-[4-[3-methyl-4-[[(1R)-1-phenylethoxy]carbonylamino]-1,2-oxazol-5-yl]phenyl]phenyl]cyclopropane-1-carboxylic acid
    SMILES: CC1=NOC(=C1NC(=O)OC(C)C2=CC=CC=C2)C3=CC=C(C=C3)C4=CC=C(C=C4)C5(CC5)C(=O)O
    InChIKey: GQBRZBHEPUQRPL-LJQANCHMSA-N
    InChI: InChI=1S/C29H26N2O5/c1-18-25(30-28(34)35-19(2)20-6-4-3-5-7-20)26(36-31-18)23-10-8-21(9-11-23)22-12-14-24(15-13-22)29(16-17-29)27(32)33/h3-15,19H,16-17H2,1-2H3,(H,30,34)(H,32,33)/t19-/m1/s1
  4. 度洛西汀
    CAS号 : 116539-59-4       
    分子式: C18H19NOS        分子量: 297.42
    IUPAC Name: (3S)-N-methyl-3-naphthalen-1-yloxy-3-thiophen-2-ylpropan-1-amine
    SMILES: CNCCC(C1=CC=CS1)OC2=CC=CC3=CC=CC=C32
    InChIKey: ZEUITGRIYCTCEM-KRWDZBQOSA-N
    InChI: InChI=1S/C18H19NOS/c1-19-12-11-17(18-10-5-13-21-18)20-16-9-4-7-14-6-2-3-8-15(14)16/h2-10,13,17,19H,11-12H2,1H3/t17-/m0/s1
  5. DASA-58
    CAS号 : 1203494-49-8       
    分子式: C19H23N3O6S2        分子量: 453.53
    IUPAC Name: 3-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1,4-diazepan-1-yl]sulfonyl]aniline
    SMILES: C1CN(CCN(C1)S(=O)(=O)C2=CC=CC(=C2)N)S(=O)(=O)C3=CC4=C(C=C3)OCCO4
    InChIKey: GMHIOMMKSMSRLY-UHFFFAOYSA-N
    InChI: InChI=1S/C19H23N3O6S2/c20-15-3-1-4-16(13-15)29(23,24)21-7-2-8-22(10-9-21)30(25,26)17-5-6-18-19(14-17)28-12-11-27-18/h1,3-6,13-14H,2,7-12,20H2
  6. Ki16425
    CAS号 : 355025-24-0       
    分子式: C23H23ClN2O5S        分子量: 474.96
    IUPAC Name: 3-[[4-[4-[1-(2-chlorophenyl)ethoxycarbonylamino]-3-methyl-1,2-oxazol-5-yl]phenyl]methylsulfanyl]propanoic acid
    SMILES: CC1=NOC(=C1NC(=O)OC(C)C2=CC=CC=C2Cl)C3=CC=C(C=C3)CSCCC(=O)O
    InChIKey: LLIFMNUXGDHTRO-UHFFFAOYSA-N
    InChI: InChI=1S/C23H23ClN2O5S/c1-14-21(25-23(29)30-15(2)18-5-3-4-6-19(18)24)22(31-26-14)17-9-7-16(8-10-17)13-32-12-11-20(27)28/h3-10,15H,11-13H2,1-2H3,(H,25,29)(H,27,28)
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