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来氟米特CAS号: 75706-12-6分子式: C12H9F3N2O2 分子量: 270.21IUPAC Name: 5-methyl-N-[4-(trifluoromethyl)phenyl]-1,2-oxazole-4-carboxamideSMILES: CC1=C(C=NO1)C(=O)NC2=CC=C(C=C2)C(F)(F)FInChIKey: VHOGYURTWQBHIL-UHFFFAOYSA-NInChI: 1S/C12H9F3N2O2/c1-7-10(6-16-19-7)11(18)17-9-4-2-8(3-5-9)12(13,14)15/h2-6H,1H3,(H,17,18)
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尼索地平CAS号: 63675-72-9 EC号: 264-407-7分子式: C20H24N2O6 分子量: 388.41IUPAC Name: 3-O-methyl 5-O-(2-methylpropyl) 2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylateSMILES: CC1=C(C(C(=C(N1)C)C(=O)OCC(C)C)C2=CC=CC=C2[N+](=O)[O-])C(=O)OCInChIKey: VKQFCGNPDRICFG-UHFFFAOYSA-NInChI: 1S/C20H24N2O6/c1-11(2)10-28-20(24)17-13(4)21-12(3)16(19(23)27-5)18(17)14-8-6-7-9-15(14)22(25)26/h6-9,11,18,21H,10H2,1-5H3
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诺考达唑CAS号: 31430-18-9 EC号: 250-626-5分子式: C14H11N3O3S 分子量: 301.32IUPAC Name: methyl N-[6-(thiophene-2-carbonyl)-1H-benzimidazol-2-yl]carbamateSMILES: COC(=O)NC1=NC2=C(N1)C=C(C=C2)C(=O)C3=CC=CS3InChIKey: KYRVNWMVYQXFEU-UHFFFAOYSA-NInChI: 1S/C14H11N3O3S/c1-20-14(19)17-13-15-9-5-4-8(7-10(9)16-13)12(18)11-3-2-6-21-11/h2-7H,1H3,(H2,15,16,17,19)
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托非索泮分子式: C22H26N2O4 分子量: 382.45IUPAC Name: 1-(3,4-dimethoxyphenyl)-5-ethyl-7,8-dimethoxy-4-methyl-5H-2,3-benzodiazepineSMILES: CCC1C(=NN=C(C2=CC(=C(C=C12)OC)OC)C3=CC(=C(C=C3)OC)OC)CInChIKey: RUJBDQSFYCKFAA-UHFFFAOYSA-NInChI: 1S/C22H26N2O4/c1-7-15-13(2)23-24-22(14-8-9-18(25-3)19(10-14)26-4)17-12-21(28-6)20(27-5)11-16(15)17/h8-12,15H,7H2,1-6H3
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3-溴-7-硝基吲唑CAS号: 74209-34-0分子式: C7H4BrN3O2 分子量: 242.03IUPAC Name: 3-bromo-7-nitro-2H-indazoleSMILES: C1=CC2=C(NN=C2C(=C1)[N+](=O)[O-])BrInChIKey: NFSTZPMYAZRZPC-UHFFFAOYSA-NInChI: 1S/C7H4BrN3O2/c8-7-4-2-1-3-5(11(12)13)6(4)9-10-7/h1-3H,(H,9,10)
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芬苯达唑CAS号: 43210-67-9分子式: C15H13N3O2S 分子量: 299.35IUPAC Name: methyl N-(6-phenylsulfanyl-1H-benzimidazol-2-yl)carbamateSMILES: COC(=O)NC1=NC2=C(N1)C=C(C=C2)SC3=CC=CC=C3InChIKey: HDDSHPAODJUKPD-UHFFFAOYSA-NInChI: 1S/C15H13N3O2S/c1-20-15(19)18-14-16-12-8-7-11(9-13(12)17-14)21-10-5-3-2-4-6-10/h2-9H,1H3,(H2,16,17,18,19)
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氟他胺CAS号: 13311-84-7分子式: C11H11F3N2O3 分子量: 276.22IUPAC Name: 2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamideSMILES: CC(C)C(=O)NC1=CC(=C(C=C1)[N+](=O)[O-])C(F)(F)FInChIKey: MKXKFYHWDHIYRV-UHFFFAOYSA-NInChI: 1S/C11H11F3N2O3/c1-6(2)10(17)15-7-3-4-9(16(18)19)8(5-7)11(12,13)14/h3-6H,1-2H3,(H,15,17)
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奋乃静分子式: C21H26ClN3OS 分子量: 403.97IUPAC Name: 2-[4-[3-(2-chlorophenothiazin-10-yl)propyl]piperazin-1-yl]ethanolSMILES: C1CN(CCN1CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl)CCOInChIKey: RGCVKNLCSQQDEP-UHFFFAOYSA-NInChI: 1S/C21H26ClN3OS/c22-17-6-7-21-19(16-17)25(18-4-1-2-5-20(18)27-21)9-3-8-23-10-12-24(13-11-23)14-15-26/h1-2,4-7,16,26H,3,8-15H2
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SCH 28080,H +,K + -ATPase抑制剂CAS号: 76081-98-6 Compound CID : 108137分子式: C17H15N3O 分子量: 277.33IUPAC Name: 2-(2-methyl-8-phenylmethoxyimidazo[1,2-a]pyridin-3-yl)acetonitrileSMILES: CC1=C(N2C=CC=C(C2=N1)OCC3=CC=CC=C3)CC#NInChIKey: PYKJFEPAUKAXNN-UHFFFAOYSA-NInChI: 1S/C17H15N3O/c1-13-15(9-10-18)20-11-5-8-16(17(20)19-13)21-12-14-6-3-2-4-7-14/h2-8,11H,9,12H2,1H3
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Piclamilast,PDE4抑制剂CAS号: 144035-83-6 Compound CID : 154575分子式: C18H18Cl2N2O3 分子量: 381.25IUPAC Name: 3-cyclopentyloxy-N-(3,5-dichloropyridin-4-yl)-4-methoxybenzamideSMILES: COC1=C(C=C(C=C1)C(=O)NC2=C(C=NC=C2Cl)Cl)OC3CCCC3InChIKey: RRRUXBQSQLKHEL-UHFFFAOYSA-NInChI: 1S/C18H18Cl2N2O3/c1-24-15-7-6-11(8-16(15)25-12-4-2-3-5-12)18(23)22-17-13(19)9-21-10-14(17)20/h6-10,12H,2-5H2,1H3,(H,21,22,23)
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