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曲格列酮CAS号: 97322-87-7 Compound CID : 5591分子式: C24H27NO5S 分子量: 441.54IUPAC Name: 5-[[4-[(6-hydroxy-2,5,7,8-tetramethyl-3,4-dihydrochromen-2-yl)methoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dioneSMILES: CC1=C(C2=C(CCC(O2)(C)COC3=CC=C(C=C3)CC4C(=O)NC(=O)S4)C(=C1O)C)CInChIKey: GXPHKUHSUJUWKP-UHFFFAOYSA-NInChI: 1S/C24H27NO5S/c1-13-14(2)21-18(15(3)20(13)26)9-10-24(4,30-21)12-29-17-7-5-16(6-8-17)11-19-22(27)25-23(28)31-19/h5-8,19,26H,9-12H2,1-4H3,(H,25,27,28)
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AM251,CB 1受体拮抗剂/反向激动剂CAS号: 183232-66-8分子式: C22H21Cl2IN4O 分子量: 555.24IUPAC Name: 1-(2,4-dichlorophenyl)-5-(4-iodophenyl)-4-methyl-N-piperidin-1-ylpyrazole-3-carboxamideSMILES: CC1=C(N(N=C1C(=O)NN2CCCCC2)C3=C(C=C(C=C3)Cl)Cl)C4=CC=C(C=C4)IInChIKey: BUZAJRPLUGXRAB-UHFFFAOYSA-NInChI: 1S/C22H21Cl2IN4O/c1-14-20(22(30)27-28-11-3-2-4-12-28)26-29(19-10-7-16(23)13-18(19)24)21(14)15-5-8-17(25)9-6-15/h5-10,13H,2-4,11-12H2,1H3,(H,27,30)
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(±)-舒必利CAS号: 15676-16-1分子式: C15H23N3O4S 分子量: 341.43IUPAC Name: N-[(1-ethylpyrrolidin-2-yl)methyl]-2-methoxy-5-sulfamoylbenzamideSMILES: CCN1CCCC1CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N)OCInChIKey: BGRJTUBHPOOWDU-UHFFFAOYSA-NInChI: 1S/C15H23N3O4S/c1-3-18-8-4-5-11(18)10-17-15(19)13-9-12(23(16,20)21)6-7-14(13)22-2/h6-7,9,11H,3-5,8,10H2,1-2H3,(H,17,19)(H2,16,20,21)
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Indisulam,分子胶CAS号: 165668-41-7分子式: C14H12ClN3O4S2 分子量: 385.85IUPAC Name: 4-N-(3-chloro-1H-indol-7-yl)benzene-1,4-disulfonamideSMILES: C1=CC2=C(C(=C1)NS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N)NC=C2ClInChIKey: SETFNECMODOHTO-UHFFFAOYSA-NInChI: 1S/C14H12ClN3O4S2/c15-12-8-17-14-11(12)2-1-3-13(14)18-24(21,22)10-6-4-9(5-7-10)23(16,19)20/h1-8,17-18H,(H2,16,19,20)
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S4,的CA IX和CA XII抑制剂CAS号: 1330061-67-0 Compound CID : 53342705分子式: C15H17N3O4S 分子量: 335.38IUPAC Name: [4-[(3,5-dimethylphenyl)carbamoylamino]phenyl] sulfamateSMILES: CC1=CC(=CC(=C1)NC(=O)NC2=CC=C(C=C2)OS(=O)(=O)N)CInChIKey: HGVHSNXRZYOTPD-UHFFFAOYSA-NInChI: 1S/C15H17N3O4S/c1-10-7-11(2)9-13(8-10)18-15(19)17-12-3-5-14(6-4-12)22-23(16,20)21/h3-9H,1-2H3,(H2,16,20,21)(H2,17,18,19)
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ZCZ011CAS号: 1998197-39-9 Compound CID : 71819307分子式: C21H18N2O2S 分子量: 362.44IUPAC Name: 6-methyl-3-(2-nitro-1-thiophen-2-ylethyl)-2-phenyl-1H-indoleSMILES: CC1=CC2=C(C=C1)C(=C(N2)C3=CC=CC=C3)C(C[N+](=O)[O-])C4=CC=CS4InChIKey: RJSPNRDBWHHFMH-UHFFFAOYSA-NInChI: 1S/C21H18N2O2S/c1-14-9-10-16-18(12-14)22-21(15-6-3-2-4-7-15)20(16)17(13-23(24)25)19-8-5-11-26-19/h2-12,17,22H,13H2,1H3
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GAT211CAS号: 102704-40-5 Compound CID : 4402318分子式: C22H18N2O2 分子量: 342.39IUPAC Name: 3-(2-nitro-1-phenylethyl)-2-phenyl-1H-indoleSMILES: C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)C(C[N+](=O)[O-])C4=CC=CC=C4InChIKey: OHZDCJJHWPHZJD-UHFFFAOYSA-NInChI: 1S/C22H18N2O2/c25-24(26)15-19(16-9-3-1-4-10-16)21-18-13-7-8-14-20(18)23-22(21)17-11-5-2-6-12-17/h1-14,19,23H,15H2
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AZD1940CAS号: 881413-29-2 Compound CID : 11675994分子式: C20H29F2N3O2S 分子量: 413.52IUPAC Name: N-[2-tert-butyl-1-[(4,4-difluorocyclohexyl)methyl]benzimidazol-5-yl]ethanesulfonamideSMILES: CCS(=O)(=O)NC1=CC2=C(C=C1)N(C(=N2)C(C)(C)C)CC3CCC(CC3)(F)FInChIKey: ZAGGGZCIFUQHOH-UHFFFAOYSA-NInChI: 1S/C20H29F2N3O2S/c1-5-28(26,27)24-15-6-7-17-16(12-15)23-18(19(2,3)4)25(17)13-14-8-10-20(21,22)11-9-14/h6-7,12,14,24H,5,8-11,13H2,1-4H3
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