化学生物学
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5-(4-氟苯基)-1,3,4-恶二唑-2(3 H )-酮CAS号 : 121649-18-1 Compound CID : 2535079分子式: C8H5FN2O2 分子量: 180.14IUPAC Name: 5-(4-fluorophenyl)-3H-1,3,4-oxadiazol-2-oneSMILES: C1=CC(=CC=C1C2=NNC(=O)O2)FInChIKey: GJHOBBCSKKRRBE-UHFFFAOYSA-NInChI: InChI=1S/C8H5FN2O2/c9-6-3-1-5(2-4-6)7-10-11-8(12)13-7/h1-4H,(H,11,12)
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5-(2-氟苯基)-1,3,4-噁二唑-2(3H)-酮CAS号 : 1044766-09-7 Compound CID : 24902248分子式: C8H5FN2O2 分子量: 180.14IUPAC Name: 5-(2-fluorophenyl)-3H-1,3,4-oxadiazol-2-oneSMILES: C1=CC=C(C(=C1)C2=NNC(=O)O2)FInChIKey: GRLMQTZJXSLUBV-UHFFFAOYSA-NInChI: InChI=1S/C8H5FN2O2/c9-6-4-2-1-3-5(6)7-10-11-8(12)13-7/h1-4H,(H,11,12)
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5-(4-硝基苯基)-3H-1,3,4-恶二唑-2-酮CAS号 : 41125-77-3 Compound CID : 12777258分子式: C8H5N3O4 分子量: 207.1IUPAC Name: 5-(4-nitrophenyl)-3H-1,3,4-oxadiazol-2-oneSMILES: C1=CC(=CC=C1C2=NNC(=O)O2)[N+](=O)[O-]InChIKey: ADUFTMJBLYUADS-UHFFFAOYSA-NInChI: InChI=1S/C8H5N3O4/c12-8-10-9-7(15-8)5-1-3-6(4-2-5)11(13)14/h1-4H,(H,10,12)
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Razaxaban盐酸盐CAS号 : 405940-76-3 Compound CID : 204101分子式: C24H21ClF4N8O2 分子量: 564.92IUPAC Name: 2-(3-amino-1,2-benzoxazol-5-yl)-N-[4-[2-[(dimethylamino)methyl]imidazol-1-yl]-2-fluorophenyl]-5-(trifluoromethyl)pyrazole-3-carboxamide;hydrochlorideSMILES: CN(C)CC1=NC=CN1C2=CC(=C(C=C2)NC(=O)C3=CC(=NN3C4=CC5=C(C=C4)ON=C5N)C(F)(F)F)F.ClInChIKey: CASCTHHMARGRLB-UHFFFAOYSA-NInChI: InChI=1S/C24H20F4N8O2.ClH/c1-34(2)12-21-30-7-8-35(21)13-3-5-17(16(25)10-13)31-23(37)18-11-20(24(26,27)28)32-36(18)14-4-6-19-15(9-14)22(29)33-38-19;/h3-11H,12H2,1-2H3,(H2,29,33)(H,31,37);1H