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BI-D1870CAS号 : 501437-28-1(DMSO)分子式: C19H23F2N5O2 分子量: 391.42SMILES: CC(C)CCN1C(C)C(=O)N(C)C2=C1N=C(NC3=CC(=C(O)C(=C3)F)F)N=C2
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BetaxololCAS号 : 63659-18-7(DMSO)分子式: C18H29NO3 分子量: 307.43SMILES: CC(C)NCC(O)COC1=CC=C(CCOCC2CC2)C=C1
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GSK1838705ACAS号 : 1116235-97-2(DMSO)分子式: C27H29FN8O3 分子量: 532.57SMILES: CNC(=O)C1=C(F)C=CC=C1NC2=C3C=C[NH]C3=NC(=N2)NC4=C(OC)C=C5CCN(C(=O)CN(C)C)C5=C4
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GSK429286ACAS号 : 864082-47-3(DMSO)分子式: C21H16F4N4O2 分子量: 432.37SMILES: CC1=C(C(CC(=O)N1)C2=CC=C(C=C2)C(F)(F)F)C(=O)NC3=C(F)C=C4[NH]N=CC4=C3
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MirabegronCAS号 : 223673-61-8(DMSO)分子式: C21H24N4O2S 分子量: 396.51SMILES: NC1=NC(=CS1)CC(=O)NC2=CC=C(CCNCC(O)C3=CC=CC=C3)C=C2
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毕卡鲁胺CAS号 : 90357-06-5(DMSO)分子式: C18H14F4N2O4S 分子量: 430.37SMILES: CC(O)(C[S](=O)(=O)C1=CC=C(F)C=C1)C(=O)NC2=CC=C(C#N)C(=C2)C(F)(F)F
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氟他胺CAS号 : 13311-84-7(DMSO)分子式: C11H11F3N2O3 分子量: 276.21SMILES: CC(C)C(=O)NC1=CC(=C(C=C1)[N+]([O-])=O)C(F)(F)F
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螺内酯CAS号 : 52-01-7(DMSO)分子式: C24H32O4S 分子量: 416.57SMILES: CC(=O)SC1CC2=CC(=O)CCC2(C)C3CCC4(C)C(CCC45CCC(=O)O5)C13
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达洛鲁胺CAS号 : 1297538-32-9(DMSO)分子式: C19H19ClN6O2 分子量: 398.85SMILES: CC(O)C1=CC(=N[NH]1)C(=O)NC(C)C[N]2C=CC(=N2)C3=CC(=C(C=C3)C#N)Cl
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醋酸环丙孕酮CAS号 : 427-51-0(DMSO)分子式: C24H29ClO4 分子量: 416.94SMILES: CC(=O)OC1(CCC2C3C=C(Cl)C4=CC(=O)C5CC5C4(C)C3CCC12C)C(C)=O
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贝特芬太罗CAS号 : 743461-65-6分子式: C40H42ClN5O7 分子量: 740.24IUPAC Name: [1-[3-[2-chloro-4-[[[(2R)-2-hydroxy-2-(8-hydroxy-2-oxo-1H-quinolin-5-yl)ethyl]amino]methyl]-5-methoxyanilino]-3-oxopropyl]piperidin-4-yl] N-(2-phenylphenyl)carbamateSMILES: COC1=CC(=C(C=C1CNCC(C2=C3C=CC(=O)NC3=C(C=C2)O)O)Cl)NC(=O)CCN4CCC(CC4)OC(=O)NC5=CC=CC=C5C6=CC=CC=C6InChIKey: URWYQGVSPQJGGB-DHUJRADRSA-NInChI: InChI=1S/C40H42ClN5O7/c1-52-36-22-33(31(41)21-26(36)23-42-24-35(48)29-11-13-34(47)39-30(29)12-14-37(49)45-39)43-38(50)17-20-46-18-15-27(16-19-46)53-40(51)44-32-10-6-5-9-28(32)25-7-3-2-4-8-25/h2-14,21-22,27,35,42,47-48H,15-20,23-24H2,1H3,(H,43,50)(H,44,51)(H,45,49)/t35-/m0/s1
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克拉斯科酮CAS号 : 19608-29-8 Compound CID : 11750009分子式: C24H34O5 分子量: 402.52IUPAC Name: [(8R,9S,10R,13S,14S,17R)-17-(2-hydroxyacetyl)-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] propanoateSMILES: CCC(=O)OC1(CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C)C(=O)COInChIKey: GPNHMOZDMYNCPO-PDUMRIMRSA-NInChI: InChI=1S/C24H34O5/c1-4-21(28)29-24(20(27)14-25)12-9-19-17-6-5-15-13-16(26)7-10-22(15,2)18(17)8-11-23(19,24)3/h13,17-19,25H,4-12,14H2,1-3H3/t17-,18+,19+,22+,23+,24+/m1/s1
