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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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Dinaciclib (SCH727965),新型CDK抑制剂CAS号: 779353-01-4分子式: C21H28N6O2 分子量: 396.49IUPAC Name: 2-[(2S)-1-[3-ethyl-7-[(1-oxidopyridin-1-ium-3-yl)methylamino]pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-2-yl]ethanolSMILES: CCC1=C2N=C(C=C(N2N=C1)NCC3=C[N+](=CC=C3)[O-])N4CCCCC4CCOInChIKey: PIMQWRZWLQKKBJ-SFHVURJKSA-NInChI: 1S/C21H28N6O2/c1-2-17-14-23-27-19(22-13-16-6-5-9-25(29)15-16)12-20(24-21(17)27)26-10-4-3-7-18(26)8-11-28/h5-6,9,12,14-15,18,22,28H,2-4,7-8,10-11,13H2,1H3/t18-/m0/s1
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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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THAL SNS 032,Cdk9降解PROTACCAS号: 2139287-33-3 Compound CID : 131801483分子式: C40H52N8O10S2 分子量: 869.02IUPAC Name: See more
SMILES: CC(C)(C)C1=CN=C(O1)CSC2=CN=C(S2)NC(=O)C3CCN(CC3)CC(=O)NCCOCCOCCOCCNC4=CC=CC5=C4C(=O)N(C5=O)C6CCC(=O)NC6=OInChIKey: BXDZOYLPNAIDOC-UHFFFAOYSA-NInChI: See more -
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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THAL SNS 032CAS号: 2139287-33-3 Compound CID : 131801483分子式: C40H52N8O10S2 分子量: 869.02IUPAC Name: See more SMILES: CC(C)(C)C1=CN=C(O1)CSC2=CN=C(S2)NC(=O)C3CCN(CC3)CC(=O)NCCOCCOCCOCCNC4=CC=CC5=C4C(=O)N(C5=O)C6CCC(=O)NC6=OInChIKey: BXDZOYLPNAIDOC-UHFFFAOYSA-NInChI: See more
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(±)-EnitociclibCAS号: 1610358-53-6分子式: C19H18F2N4O2S 分子量: 404.4IUPAC Name: 5-fluoro-4-(4-fluoro-2-methoxyphenyl)-N-[4-[(methylsulfonimidoyl)methyl]pyridin-2-yl]pyridin-2-amineSMILES: COC1=C(C=CC(=C1)F)C2=CC(=NC=C2F)NC3=NC=CC(=C3)CS(=N)(=O)CInChIKey: YZCUMZWULWOUMD-UHFFFAOYSA-NInChI: 1S/C19H18F2N4O2S/c1-27-17-8-13(20)3-4-14(17)15-9-19(24-10-16(15)21)25-18-7-12(5-6-23-18)11-28(2,22)26/h3-10,22H,11H2,1-2H3,(H,23,24,25)
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(-)-EnitociclibCAS号: 1610358-59-2分子式: C19H18F2N4O2S 分子量: 404.43IUPAC Name: 5-fluoro-4-(4-fluoro-2-methoxyphenyl)-N-[4-[(methylsulfonimidoyl)methyl]pyridin-2-yl]pyridin-2-amineSMILES: COC1=C(C=CC(=C1)F)C2=CC(=NC=C2F)NC3=NC=CC(=C3)CS(=N)(=O)CInChIKey: YZCUMZWULWOUMD-UHFFFAOYSA-NInChI: 1S/C19H18F2N4O2S/c1-27-17-8-13(20)3-4-14(17)15-9-19(24-10-16(15)21)25-18-7-12(5-6-23-18)11-28(2,22)26/h3-10,22H,11H2,1-2H3,(H,23,24,25)
