Phosphatase
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PTP1B-IN-2CAS号 : 1919853-46-5 Compound CID : 127050086分子式: C34H36N2O9S2 分子量: 680.79IUPAC Name: methyl 5-[benzylsulfonyl-[[4-[(2-methoxy-2-oxoethyl)-methylsulfonylamino]phenyl]methyl]amino]-2-[(4-methylphenyl)methoxy]benzoateSMILES: CC1=CC=C(C=C1)COC2=C(C=C(C=C2)N(CC3=CC=C(C=C3)N(CC(=O)OC)S(=O)(=O)C)S(=O)(=O)CC4=CC=CC=C4)C(=O)OCInChIKey: IPNJQCVHNPGYOX-UHFFFAOYSA-NInChI: InChI=1S/C34H36N2O9S2/c1-25-10-12-27(13-11-25)23-45-32-19-18-30(20-31(32)34(38)44-3)36(47(41,42)24-28-8-6-5-7-9-28)21-26-14-16-29(17-15-26)35(46(4,39)40)22-33(37)43-2/h5-20H,21-24H2,1-4H3
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KY-226CAS号 : 1621673-53-7 Compound CID : 76955652分子式: C27H31NO3S2 分子量: 481.67IUPAC Name: N-hexylsulfonyl-4-[(4-phenylphenyl)methylsulfanylmethyl]benzamideSMILES: CCCCCCS(=O)(=O)NC(=O)C1=CC=C(C=C1)CSCC2=CC=C(C=C2)C3=CC=CC=C3InChIKey: MKXMABKUVSOEJF-UHFFFAOYSA-NInChI: InChI=1S/C27H31NO3S2/c1-2-3-4-8-19-33(30,31)28-27(29)26-17-13-23(14-18-26)21-32-20-22-11-15-25(16-12-22)24-9-6-5-7-10-24/h5-7,9-18H,2-4,8,19-21H2,1H3,(H,28,29)
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PDM-11CAS号 : 1032508-03-4 Compound CID : 49799318分子式: C16H15ClO2 分子量: 274.74IUPAC Name: 1-[(E)-2-(4-chlorophenyl)ethenyl]-3,5-dimethoxybenzeneSMILES: COC1=CC(=CC(=C1)C=CC2=CC=C(C=C2)Cl)OCInChIKey: VPHHOTWBLKKBBT-ONEGZZNKSA-NInChI: InChI=1S/C16H15ClO2/c1-18-15-9-13(10-16(11-15)19-2)4-3-12-5-7-14(17)8-6-12/h3-11H,1-2H3/b4-3+
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F1063-0967CAS号 : 613225-56-2 Compound CID : 5895168分子式: C24H24N2O5S2 分子量: 484.59IUPAC Name: 2-hydroxy-4-[6-[(5Z)-5-[(4-methylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoylamino]benzoic acidSMILES: CC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCCCCC(=O)NC3=CC(=C(C=C3)C(=O)O)OInChIKey: RNICWTYEMLCCAS-MOSHPQCFSA-NInChI: InChI=1S/C24H24N2O5S2/c1-15-6-8-16(9-7-15)13-20-22(29)26(24(32)33-20)12-4-2-3-5-21(28)25-17-10-11-18(23(30)31)19(27)14-17/h6-11,13-14,27H,2-5,12H2,1H3,(H,25,28)(H,30,31)/b20-13-
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BCICAS号 : 1245792-51-1 Compound CID : 6419844分子式: C22H23NO 分子量: 317.42IUPAC Name: (2E)-2-benzylidene-3-(cyclohexylamino)-3H-inden-1-oneSMILES: C1CCC(CC1)NC2C3=CC=CC=C3C(=O)C2=CC4=CC=CC=C4InChIKey: XJDKPLZUXCIMIS-HMMYKYKNSA-NInChI: InChI=1S/C22H23NO/c24-22-19-14-8-7-13-18(19)21(23-17-11-5-2-6-12-17)20(22)15-16-9-3-1-4-10-16/h1,3-4,7-10,13-15,17,21,23H,2,5-6,11-12H2/b20-15+
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ML095盐酸盐CAS号 : 1135318-57-8 Compound CID : 25067483分子式: C13H15ClN2O3 分子量: 282.72IUPAC Name: 1-(3,4-dihydroxyphenyl)-2-(2-ethylimidazol-1-yl)ethanone;hydrochlorideSMILES: CCC1=NC=CN1CC(=O)C2=CC(=C(C=C2)O)O.ClInChIKey: VTSPJLHFXSMCCC-UHFFFAOYSA-NInChI: InChI=1S/C13H14N2O3.ClH/c1-2-13-14-5-6-15(13)8-12(18)9-3-4-10(16)11(17)7-9;/h3-7,16-17H,2,8H2,1H3;1H
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AQX-016ACAS号 : 849669-54-1 Compound CID : 45028212分子式: C22H32O2 分子量: 328.5IUPAC Name: (6aR,11aR,11bS)-4,4,6a,7,11b-pentamethyl-1,2,3,4a,5,6,11,11a-octahydrobenzo[a]fluorene-9,10-diolSMILES: CC1=CC(=C(C2=C1C3(CCC4C(CCCC4(C3C2)C)(C)C)C)O)OInChIKey: DTFQQAANPRPMBC-CZVICOMLSA-NInChI: InChI=1S/C22H32O2/c1-13-11-15(23)19(24)14-12-17-21(4)9-6-8-20(2,3)16(21)7-10-22(17,5)18(13)14/h11,16-17,23-24H,6-10,12H2,1-5H3/t16?,17-,21+,22-/m1/s1
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NSC87877CAS号 : 56932-43-5 Compound CID : 92576分子式: C19H13N3O7S2.2Na 分子量: 503.42IUPAC Name: disodium;8-hydroxy-7-[(6-sulfonatonaphthalen-2-yl)diazenyl]quinoline-5-sulfonateSMILES: C1=CC2=C(C=C(C(=C2N=C1)O)N=NC3=CC4=C(C=C3)C=C(C=C4)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]InChIKey: IFVGQKHFUZRWNA-UHFFFAOYSA-LInChI: InChI=1S/C19H13N3O7S2.2Na/c23-19-16(10-17(31(27,28)29)15-2-1-7-20-18(15)19)22-21-13-5-3-12-9-14(30(24,25)26)6-4-11(12)8-13;;/h1-10,23H,(H,24,25,26)(H,27,28,29);;/q;2*+1/p-2
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Rbin-1CAS号 : 328023-11-6 Compound CID : 5731061分子式: C13H12N4S 分子量: 256.33IUPAC Name: 3-(2-methylprop-2-enylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indoleSMILES: CC(=C)CSC1=NC2=C(C3=CC=CC=C3N2)N=N1InChIKey: LPCWHNSRTRBKBO-UHFFFAOYSA-NInChI: InChI=1S/C13H12N4S/c1-8(2)7-18-13-15-12-11(16-17-13)9-5-3-4-6-10(9)14-12/h3-6H,1,7H2,2H3,(H,14,15,17)
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RMC-4550CAS号 : 2172651-73-7 Compound CID : 134183206分子式: C21H26Cl2N4O2 分子量: 437.36IUPAC Name: [3-[(3S,4S)-4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl]-6-(2,3-dichlorophenyl)-5-methylpyrazin-2-yl]methanolSMILES: CC1C(C2(CCN(CC2)C3=NC(=C(N=C3CO)C4=C(C(=CC=C4)Cl)Cl)C)CO1)NInChIKey: IKUYEYLZXGGCRD-ORAYPTAESA-NInChI: InChI=1S/C21H26Cl2N4O2/c1-12-18(14-4-3-5-15(22)17(14)23)26-16(10-28)20(25-12)27-8-6-21(7-9-27)11-29-13(2)19(21)24/h3-5,13,19,28H,6-11,24H2,1-2H3/t13-,19+/m0/s1
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DT-061 (SMAP)CAS号 : 1809427-19-7 Compound CID : 91885558分子式: C25H23F3N2O5S 分子量: 520.52IUPAC Name: N-[(1R,2R,3S)-2-hydroxy-3-phenoxazin-10-ylcyclohexyl]-4-(trifluoromethoxy)benzenesulfonamideSMILES: C1CC(C(C(C1)N2C3=CC=CC=C3OC4=CC=CC=C42)O)NS(=O)(=O)C5=CC=C(C=C5)OC(F)(F)FInChIKey: WGKGADVPRVLHHZ-ZHRMCQFGSA-NInChI: InChI=1S/C25H23F3N2O5S/c26-25(27,28)35-16-12-14-17(15-13-16)36(32,33)29-18-6-5-9-21(24(18)31)30-19-7-1-3-10-22(19)34-23-11-4-2-8-20(23)30/h1-4,7-8,10-15,18,21,24,29,31H,5-6,9H2/t18-,21+,24+/m1/s1
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NCGC00378430CAS号 : 920650-00-6 Compound CID : 16361161分子式: C22H23N3O5S 分子量: 441.5IUPAC Name: N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)-3-pyrrol-1-ylbenzamideSMILES: COC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)N3C=CC=C3)S(=O)(=O)N4CCOCC4InChIKey: IFXCVBOQNYHBMX-UHFFFAOYSA-NInChI: InChI=1S/C22H23N3O5S/c1-29-20-8-7-18(16-21(20)31(27,28)25-11-13-30-14-12-25)23-22(26)17-5-4-6-19(15-17)24-9-2-3-10-24/h2-10,15-16H,11-14H2,1H3,(H,23,26)