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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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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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恩替诺特 (MS-275)CAS号: 209783-80-2分子式: C21H20N4O3 分子量: 376.41IUPAC Name: pyridin-3-ylmethyl N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamateSMILES: C1=CC=C(C(=C1)N)NC(=O)C2=CC=C(C=C2)CNC(=O)OCC3=CN=CC=C3InChIKey: INVTYAOGFAGBOE-UHFFFAOYSA-NInChI: 1S/C21H20N4O3/c22-18-5-1-2-6-19(18)25-20(26)17-9-7-15(8-10-17)13-24-21(27)28-14-16-4-3-11-23-12-16/h1-12H,13-14,22H2,(H,24,27)(H,25,26)
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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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Tubacin,HDAC6抑制剂CAS号: 1350555-93-9 Compound CID : 6675804分子式: C41H43N3O7S 分子量: 721.86IUPAC Name: N-[4-[(2R,4R,6S)-4-[(4,5-diphenyl-1,3-oxazol-2-yl)sulfanylmethyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl]phenyl]-N'-hydroxyoctanediamideSMILES: C1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC=C(C=C3)NC(=O)CCCCCCC(=O)NO)CSC4=NC(=C(O4)C5=CC=CC=C5)C6=CC=CC=C6InChIKey: BHUZLJOUHMBZQY-YXQOSMAKSA-NInChI: See more
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CHDI 00390576,IIa类HDAC抑制剂CAS号: 1629729-98-1分子式: C19H13F4N3O2 分子量: 391.32IUPAC Name: 2-(2-fluorophenyl)-N-hydroxy-2-[4-[5-(trifluoromethyl)pyrimidin-2-yl]phenyl]acetamideSMILES: C1=CC=C(C(=C1)C(C2=CC=C(C=C2)C3=NC=C(C=N3)C(F)(F)F)C(=O)NO)FInChIKey: LMGDHGQJJLEAPQ-UHFFFAOYSA-NInChI: 1S/C19H13F4N3O2/c20-15-4-2-1-3-14(15)16(18(27)26-28)11-5-7-12(8-6-11)17-24-9-13(10-25-17)19(21,22)23/h1-10,16,28H,(H,26,27)
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IpidacrineCAS号: 62732-44-9 Compound CID : 604519分子式: C12H16N2 分子量: 188.274IUPAC Name: 2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-amineSMILES: C1CCC2=C(C1)C(=C3CCCC3=N2)NInChIKey: YLUSMKAJIQOXPV-UHFFFAOYSA-NInChI: 1S/C12H16N2/c13-12-8-4-1-2-6-10(8)14-11-7-3-5-9(11)12/h1-7H2,(H2,13,14)
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GNE-900CAS号: 1200126-26-6 Compound CID : 44545757分子式: C23H21N5 分子量: 367.45IUPAC Name: 12-[4-(piperidin-1-ylmethyl)phenyl]-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-4-carbonitrileSMILES: C1CCN(CC1)CC2=CC=C(C=C2)C3=CC4=C(NC5=C4C=C(N=C5)C#N)N=C3InChIKey: PPYHOOZGDDPLKM-UHFFFAOYSA-NInChI: 1S/C23H21N5/c24-12-19-11-20-21-10-18(13-26-23(21)27-22(20)14-25-19)17-6-4-16(5-7-17)15-28-8-2-1-3-9-28/h4-7,10-11,13-14H,1-3,8-9,15H2,(H,26,27)
