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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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卡巴拉汀CAS号: 123441-03-2 Compound CID : 77991分子式: C14H22N2O2 分子量: 250.34IUPAC Name: [3-[(1S)-1-(dimethylamino)ethyl]phenyl] N-ethyl-N-methylcarbamateSMILES: CCN(C)C(=O)OC1=CC=CC(=C1)C(C)N(C)CInChIKey: XSVMFMHYUFZWBK-NSHDSACASA-NInChI: 1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1
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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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甲基硫酸新斯的明分子式: C13H22N2O6S 分子量: 334.39IUPAC Name: [3-(dimethylcarbamoyloxy)phenyl]-trimethylazanium;methyl sulfateSMILES: CN(C)C(=O)OC1=CC=CC(=C1)[N+](C)(C)C.COS(=O)(=O)[O-]InChIKey: OSZNNLWOYWAHSS-UHFFFAOYSA-MInChI: 1S/C12H19N2O2.CH4O4S/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5;1-5-6(2,3)4/h6-9H,1-5H3;1H3,(H,2,3,4)/q+1;/p-1
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盐酸多奈哌齐CAS号: 120011-70-3分子式: C24H29NO3·HCl 分子量: 415.96IUPAC Name: 2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydroinden-1-one;hydrochlorideSMILES: COC1=C(C=C2C(=C1)CC(C2=O)CC3CCN(CC3)CC4=CC=CC=C4)OC.ClInChIKey: XWAIAVWHZJNZQQ-UHFFFAOYSA-NInChI: 1S/C24H29NO3.ClH/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18;/h3-7,14-15,17,20H,8-13,16H2,1-2H3;1H
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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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溴化新斯的明CAS号: 114-80-7分子式: C12H19BrN2O2 分子量: 303.2IUPAC Name: [3-(dimethylcarbamoyloxy)phenyl]-trimethylazanium;bromideSMILES: CN(C)C(=O)OC1=CC=CC(=C1)[N+](C)(C)C.[Br-]InChIKey: LULNWZDBKTWDGK-UHFFFAOYSA-MInChI: 1S/C12H19N2O2.BrH/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5;/h6-9H,1-5H3;1H/q+1;/p-1
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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
