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西替利嗪CAS号 : 83881-51-0 Compound CID : 2678分子式: C21H25ClN2O3 分子量: 388.89IUPAC Name: 2-[2-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]ethoxy]acetic acidSMILES: C1CN(CCN1CCOCC(=O)O)C(C2=CC=CC=C2)C3=CC=C(C=C3)ClInChIKey: ZKLPARSLTMPFCP-UHFFFAOYSA-NInChI: InChI=1S/C21H25ClN2O3/c22-19-8-6-18(7-9-19)21(17-4-2-1-3-5-17)24-12-10-23(11-13-24)14-15-27-16-20(25)26/h1-9,21H,10-16H2,(H,25,26)
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氯雷他定CAS号 : 79794-75-5 Compound CID : 3957分子式: C22H23ClN2O2 分子量: 382.88IUPAC Name: ethyl 4-(13-chloro-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-ylidene)piperidine-1-carboxylateSMILES: CCOC(=O)N1CCC(=C2C3=C(CCC4=C2N=CC=C4)C=C(C=C3)Cl)CC1InChIKey: JCCNYMKQOSZNPW-UHFFFAOYSA-NInChI: InChI=1S/C22H23ClN2O2/c1-2-27-22(26)25-12-9-15(10-13-25)20-19-8-7-18(23)14-17(19)6-5-16-4-3-11-24-21(16)20/h3-4,7-8,11,14H,2,5-6,9-10,12-13H2,1H3
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JNJ39758979,组胺H4受体拮抗剂CAS号 : 1046447-90-8 Compound CID : 24994634分子式: C11H19N5 分子量: 221.30IUPAC Name: 4-[(3R)-3-aminopyrrolidin-1-yl]-6-propan-2-ylpyrimidin-2-amineSMILES: CC(C)C1=CC(=NC(=N1)N)N2CCC(C2)NInChIKey: COOGVHJHSCBOQT-MRVPVSSYSA-NInChI: InChI=1S/C11H19N5/c1-7(2)9-5-10(15-11(13)14-9)16-4-3-8(12)6-16/h5,7-8H,3-4,6,12H2,1-2H3,(H2,13,14,15)/t8-/m1/s1
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羟嗪分子式: C21H27ClN2O2 分子量: 374.9IUPAC Name: 2-[2-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]ethoxy]ethanolSMILES: C1CN(CCN1CCOCCO)C(C2=CC=CC=C2)C3=CC=C(C=C3)ClInChIKey: ZQDWXGKKHFNSQK-UHFFFAOYSA-NInChI: InChI=1S/C21H27ClN2O2/c22-20-8-6-19(7-9-20)21(18-4-2-1-3-5-18)24-12-10-23(11-13-24)14-16-26-17-15-25/h1-9,21,25H,10-17H2
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非索非那定CAS号 : 83799-24-0 Compound CID : 3348分子式: C32H39NO4 分子量: 501.66IUPAC Name: 2-[4-[1-hydroxy-4-[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]butyl]phenyl]-2-methylpropanoic acidSMILES: CC(C)(C1=CC=C(C=C1)C(CCCN2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)O)C(=O)OInChIKey: RWTNPBWLLIMQHL-UHFFFAOYSA-NInChI: InChI=1S/C32H39NO4/c1-31(2,30(35)36)25-17-15-24(16-18-25)29(34)14-9-21-33-22-19-28(20-23-33)32(37,26-10-5-3-6-11-26)27-12-7-4-8-13-27/h3-8,10-13,15-18,28-29,34,37H,9,14,19-23H2,1-2H3,(H,35,36)
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(S)-(+)-马来酸二甲茚CAS号 : 121367-05-3 Compound CID : 6604866分子式: C₂₀H₂₄N₂・C4H4O₄ 分子量: 408.5IUPAC Name: N,N-dimethyl-2-[3-[(1S)-1-pyridin-2-ylethyl]-1H-inden-2-yl]ethanamineSMILES: CC(C1=CC=CC=N1)C2=C(CC3=CC=CC=C32)CCN(C)CInChIKey: MVMQESMQSYOVGV-OAHLLOKOSA-NInChI: InChI=1S/C20H24N2/c1-15(19-10-6-7-12-21-19)20-17(11-13-22(2)3)14-16-8-4-5-9-18(16)20/h4-10,12,15H,11,13-14H2,1-3H3/t15-/m1/s1
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特非那定CAS号 : 50679-08-8 Compound CID : 5405分子式: C32H41NO2 分子量: 471.67IUPAC Name: 1-(4-tert-butylphenyl)-4-[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]butan-1-olSMILES: CC(C)(C)C1=CC=C(C=C1)C(CCCN2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)OInChIKey: GUGOEEXESWIERI-UHFFFAOYSA-NInChI: InChI=1S/C32H41NO2/c1-31(2,3)26-18-16-25(17-19-26)30(34)15-10-22-33-23-20-29(21-24-33)32(35,27-11-6-4-7-12-27)28-13-8-5-9-14-28/h4-9,11-14,16-19,29-30,34-35H,10,15,20-24H2,1-3H3
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