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HPV
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N-(对甲苯磺酰基)-L-苯丙氨酰甲基氯酮（TPCK）分子式: C17H18ClNO3S 分子量: 351.85IUPAC Name: N-[(2S)-4-chloro-3-oxo-1-phenylbutan-2-yl]-4-methylbenzenesulfonamideSMILES: CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)CClInChIKey: MQUQNUAYKLCRME-INIZCTEOSA-NInChI: 1S/C17H18ClNO3S/c1-13-7-9-15(10-8-13)23(21,22)19-16(17(20)12-18)11-14-5-3-2-4-6-14/h2-10,16,19H,11-12H2,1H3/t16-/m0/s1
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N-羟基-N'-苯基辛二酰胺CAS号: 149647-78-9 Compound CID : 5311分子式: C14H20N2O3 分子量: 264.32IUPAC Name: N'-hydroxy-N-phenyloctanediamideSMILES: C1=CC=C(C=C1)NC(=O)CCCCCCC(=O)NOInChIKey: WAEXFXRVDQXREF-UHFFFAOYSA-NInChI: 1S/C14H20N2O3/c17-13(15-12-8-4-3-5-9-12)10-6-1-2-7-11-14(18)16-19/h3-5,8-9,19H,1-2,6-7,10-11H2,(H,15,17)(H,16,18)
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异丙肌苷CAS号: 36703-88-5 Compound CID : 135449284分子式: C10H12N4O5·3C9H9NO3·3C5H13NO 分子量: 1115.25IUPAC Name: 4-acetamidobenzoic acid;9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1H-purin-6-one;1-(dimethylamino)propan-2-olSMILES: CC(CN(C)C)O.CC(CN(C)C)O.CC(CN(C)C)O.CC(=O)NC1=CC=C(C=C1)C(=O)O.CC(=O)NC1=CC=C(C=C1)C(=O)O.CC(=O)NC1=CC=C(C=C1)C(=O)O.C1=NC2=C(C(=O)N1)N=CN2C3C(C(C(O3)CO)O)OInChIKey: YLDCUKJMEKGGFI-QCSRICIXSA-NInChI: See more
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异丙肌苷CAS号: 36703-88-5 Compound CID : 135449284分子式: C10H12N4O5·3C9H9NO3·3C5H13NO 分子量: 1115.25IUPAC Name: 4-acetamidobenzoic acid;9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1H-purin-6-one;1-(dimethylamino)propan-2-olSMILES: CC(CN(C)C)O.CC(CN(C)C)O.CC(CN(C)C)O.CC(=O)NC1=CC=C(C=C1)C(=O)O.CC(=O)NC1=CC=C(C=C1)C(=O)O.CC(=O)NC1=CC=C(C=C1)C(=O)O.C1=NC2=C(C(=O)N1)N=CN2C3C(C(C(O3)CO)O)OInChIKey: YLDCUKJMEKGGFI-QCSRICIXSA-NInChI: See more
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sabizabulinIUPAC Name: [2-(1H-indol-3-yl)-1H-imidazol-5-yl]-(3,4,5-trimethoxyphenyl)methanoneSMILES: COC1=CC(=CC(=C1OC)OC)C(=O)C2=CN=C(N2)C3=CNC4=CC=CC=C43InChIKey: WQGVHOVEXMOLOK-UHFFFAOYSA-NInChI: 1S/C21H19N3O4/c1-26-17-8-12(9-18(27-2)20(17)28-3)19(25)16-11-23-21(24-16)14-10-22-15-7-5-4-6-13(14)15/h4-11,22H,1-3H3,(H,23,24)
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Vorinostat-d5CAS号: 1132749-48-4 Compound CID : 25235331分子式: C14H15D5N2O3 分子量: 269.35IUPAC Name: N'-hydroxy-N-(2,3,4,5,6-pentadeuteriophenyl)octanediamideSMILES: C1=CC=C(C=C1)NC(=O)CCCCCCC(=O)NOInChIKey: WAEXFXRVDQXREF-YQYLVRRTSA-NInChI: 1S/C14H20N2O3/c17-13(15-12-8-4-3-5-9-12)10-6-1-2-7-11-14(18)16-19/h3-5,8-9,19H,1-2,6-7,10-11H2,(H,15,17)(H,16,18)/i3D,4D,5D,8D,9D
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A2ti-2CAS号: 482646-13-9 Compound CID : 1076904分子式: C18H18N4O2S 分子量: 354.43IUPAC Name: 2-[[5-[(2-methylphenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamideSMILES: CC1=CC=CC=C1OCC2=NN=C(N2C3=CC=CC=C3)SCC(=O)NInChIKey: DRZJLOOZLBTLAL-UHFFFAOYSA-NInChI: 1S/C18H18N4O2S/c1-13-7-5-6-10-15(13)24-11-17-20-21-18(25-12-16(19)23)22(17)14-8-3-2-4-9-14/h2-10H,11-12H2,1H3,(H2,19,23)
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Retro-2 cyclCAS号: 1429192-00-6 Compound CID : 71716811分子式: C19H16N2OS 分子量: 320.41IUPAC Name: 2-(5-methylthiophen-2-yl)-3-phenyl-1,2-dihydroquinazolin-4-oneSMILES: CC1=CC=C(S1)C2NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4InChIKey: BOAPXDSRULBILC-UHFFFAOYSA-NInChI: 1S/C19H16N2OS/c1-13-11-12-17(23-13)18-20-16-10-6-5-9-15(16)19(22)21(18)14-7-3-2-4-8-14/h2-12,18,20H,1H3
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Teslexivir hydrochlorideCAS号: 1075281-70-7分子式: C35H37BrClN3O4 分子量: 679.04SMILES: O=C(CC1=CC(OC)=C(C(O)=O)C=C1Br)NN(C2=CC=C(CC3=CC=CC=C3)C=C2)C4=C(N5CCCCC5)C=CC=C4C.[H]Cl
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A2ti-1CAS号: 570390-00-0 Compound CID : 1431565分子式: C20H22N4O2S 分子量: 382.48IUPAC Name: 2-[[4-(2-ethylphenyl)-5-[(2-methylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetamideSMILES: CCC1=CC=CC=C1N2C(=NN=C2SCC(=O)N)COC3=CC=CC=C3CInChIKey: KNQGIFUBCFRGDB-UHFFFAOYSA-NInChI: 1S/C20H22N4O2S/c1-3-15-9-5-6-10-16(15)24-19(22-23-20(24)27-13-18(21)25)12-26-17-11-7-4-8-14(17)2/h4-11H,3,12-13H2,1-2H3,(H2,21,25)
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Gsk983CAS号: 827591-02-6 Compound CID : 11416123分子式: C18H16ClN3O 分子量: 325.79IUPAC Name: N-[(1R)-6-chloro-2,3,4,9-tetrahydro-1H-carbazol-1-yl]pyridine-2-carboxamideSMILES: C1CC(C2=C(C1)C3=C(N2)C=CC(=C3)Cl)NC(=O)C4=CC=CC=N4InChIKey: WJQBOBGVBBZLJU-OAHLLOKOSA-NInChI: 1S/C18H16ClN3O/c19-11-7-8-14-13(10-11)12-4-3-6-15(17(12)21-14)22-18(23)16-5-1-2-9-20-16/h1-2,5,7-10,15,21H,3-4,6H2,(H,22,23)/t15-/m1/s1
