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Onalespib (AT13387)CAS号 : 912999-49-6(DMSO)分子式: C24H31N3O3 分子量: 409.52SMILES: CC(C)C1=C(O)C=C(O)C(=C1)C(=O)N2CC3=C(C2)C=C(CN4CCN(C)CC4)C=C3
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Ganetespib (STA-9090)CAS号 : 888216-25-9(DMSO)分子式: C20H20N4O3 分子量: 364.4SMILES: CC(C)C1=C(O)C=C(O)C(=C1)C2=NNC(=O)N2C3=CC4=C(C=C3)[N](C)C=C4
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格尔德霉素CAS号 : 30562-34-6(DMSO)分子式: C29H40N2O9 分子量: 560.64SMILES: COC1CC(C)CC2=C(OC)C(=O)C=C(NC(=O)\C(=C\C=C\C(OC)C(OC(N)=O)\C(=C\C(C)C1O)C)C)C2=O
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BromosporineCAS号 : 1619994-69-2分子式: C17H20N6O4S 分子量: 404.44IUPAC Name: ethyl N-[6-[3-(methanesulfonamido)-4-methylphenyl]-3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-8-yl]carbamateSMILES: CCOC(=O)NC1=CC(=NN2C1=NN=C2C)C3=CC(=C(C=C3)C)NS(=O)(=O)CInChIKey: UYBRROMMFMPJAN-UHFFFAOYSA-NInChI: InChI=1S/C17H20N6O4S/c1-5-27-17(24)18-15-9-14(21-23-11(3)19-20-16(15)23)12-7-6-10(2)13(8-12)22-28(4,25)26/h6-9,22H,5H2,1-4H3,(H,18,24)
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BI-7273CAS号 : 1883429-21-7分子式: C20H23N3O3 分子量: 353.41IUPAC Name: 4-[4-[(dimethylamino)methyl]-3,5-dimethoxyphenyl]-2-methyl-2,7-naphthyridin-1-oneSMILES: CN1C=C(C2=C(C1=O)C=NC=C2)C3=CC(=C(C(=C3)OC)CN(C)C)OCInChIKey: RBUYFHLQNPJMQM-UHFFFAOYSA-NInChI: InChI=1S/C20H23N3O3/c1-22(2)11-17-18(25-4)8-13(9-19(17)26-5)16-12-23(3)20(24)15-10-21-7-6-14(15)16/h6-10,12H,11H2,1-5H3
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BIIB021CAS号 : 848695-25-0分子式: C14H15ClN6O 分子量: 318.77IUPAC Name: 6-chloro-9-[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]purin-2-amineSMILES: CC1=CN=C(C(=C1OC)C)CN2C=NC3=C2N=C(N=C3Cl)NInChIKey: QULDDKSCVCJTPV-UHFFFAOYSA-NInChI: InChI=1S/C14H15ClN6O/c1-7-4-17-9(8(2)11(7)22-3)5-21-6-18-10-12(15)19-14(16)20-13(10)21/h4,6H,5H2,1-3H3,(H2,16,19,20)
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CPI-637CAS号 : 1884712-47-3分子式: C22H22N6O 分子量: 386.45IUPAC Name: (4R)-4-methyl-6-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-5-yl]-1,3,4,5-tetrahydro-1,5-benzodiazepin-2-oneSMILES: CC1CC(=O)NC2=CC=CC(=C2N1)C3=CC4=C(C=C3)N(N=C4C5=CN(N=C5)C)CInChIKey: BFTKDWYIRJGJCA-CYBMUJFWSA-NInChI: InChI=1S/C22H22N6O/c1-13-9-20(29)25-18-6-4-5-16(22(18)24-13)14-7-8-19-17(10-14)21(26-28(19)3)15-11-23-27(2)12-15/h4-8,10-13,24H,9H2,1-3H3,(H,25,29)/t13-/m1/s1
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I-BRD9CAS号 : 1714146-59-4分子式: C22H22F3N3O3S2 分子量: 497.55IUPAC Name: N'-(1,1-dioxothian-4-yl)-5-ethyl-4-oxo-7-[3-(trifluoromethyl)phenyl]thieno[3,2-c]pyridine-2-carboximidamideSMILES: CCN1C=C(C2=C(C1=O)C=C(S2)C(=NC3CCS(=O)(=O)CC3)N)C4=CC(=CC=C4)C(F)(F)FInChIKey: WRUWGLUCNBMGPS-UHFFFAOYSA-NInChI: InChI=1S/C22H22F3N3O3S2/c1-2-28-12-17(13-4-3-5-14(10-13)22(23,24)25)19-16(21(28)29)11-18(32-19)20(26)27-15-6-8-33(30,31)9-7-15/h3-5,10-12,15H,2,6-9H2,1H3,(H2,26,27)
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TAS-116CAS号 : 1260533-36-5 Compound CID : 67501411分子式: C25H26N8O 分子量: 454.53IUPAC Name: 3-ethyl-4-[4-[4-(1-methylpyrazol-4-yl)imidazol-1-yl]-3-propan-2-ylpyrazolo[3,4-b]pyridin-1-yl]benzamideSMILES: CCC1=C(C=CC(=C1)C(=O)N)N2C3=NC=CC(=C3C(=N2)C(C)C)N4C=C(N=C4)C5=CN(N=C5)CInChIKey: NVVPMZUGELHVMH-UHFFFAOYSA-NInChI: InChI=1S/C25H26N8O/c1-5-16-10-17(24(26)34)6-7-20(16)33-25-22(23(30-33)15(2)3)21(8-9-27-25)32-13-19(28-14-32)18-11-29-31(4)12-18/h6-15H,5H2,1-4H3,(H2,26,34)
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VER-50589CAS号 : 747413-08-7 Compound CID : 135446210分子式: C19H17ClN2O5 分子量: 388.8IUPAC Name: 5-(5-chloro-2,4-dihydroxyphenyl)-N-ethyl-4-(4-methoxyphenyl)-1,2-oxazole-3-carboxamideSMILES: CCNC(=O)C1=NOC(=C1C2=CC=C(C=C2)OC)C3=CC(=C(C=C3O)O)ClInChIKey: JXPCDMPJCKNLBY-UHFFFAOYSA-NInChI: InChI=1S/C19H17ClN2O5/c1-3-21-19(25)17-16(10-4-6-11(26-2)7-5-10)18(27-22-17)12-8-13(20)15(24)9-14(12)23/h4-9,23-24H,3H2,1-2H3,(H,21,25)
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VER-49009CAS号 : 940289-57-6 Compound CID : 4369536分子式: C19H18ClN3O4 分子量: 387.8IUPAC Name: 3-(5-chloro-2,4-dihydroxyphenyl)-N-ethyl-4-(4-methoxyphenyl)-1H-pyrazole-5-carboxamideSMILES: CCNC(=O)C1=C(C(=NN1)C2=CC(=C(C=C2O)O)Cl)C3=CC=C(C=C3)OCInChIKey: HUNAOTXNHVALTN-UHFFFAOYSA-NInChI: InChI=1S/C19H18ClN3O4/c1-3-21-19(26)18-16(10-4-6-11(27-2)7-5-10)17(22-23-18)12-8-13(20)15(25)9-14(12)24/h4-9,24-25H,3H2,1-2H3,(H,21,26)(H,22,23)
