HRID1919032

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CC(=O)OCc1c(B2OC(C)(C)C(C)(C)O2)cccc1N1CCc2c(sc3c2CCCC3)C1=O

HCID58043718

未命名化合物

结构：CCN1CC(c2ccc(Nc3cc(Br)cn(C)c3=O)nc2)C1

HCID58044141

未命名化合物

结构：CC(=O)OCc1c(-c2cc(Nc3cc(C4CC4)[nH]n3)c(=O)n(C)c2)cc(F)cc1N1CCc2c(sc3c2CCCC3)C1=O

HCID67016583

未命名化合物

PRODUCTS

生成物

结构：CCN1CC(c2ccc(Nc3cc(-c4cc(F)cc(N5CCc6c(sc7c6CCCC7)C5=O)c4COC(C)=O)cn(C)c3=O)nc2)C1

HCID67016480

未命名化合物

收率 67%

PROCEDURE

实验过程

Following the procedures as described for 136e and starting with 5-bromo-3-(5-(1-ethylazetidin-3-yl)pyridin-2-ylamino)-1-methylpyridin-2(1H)-one (250a) and (4-fluoro-2-{6-oxo-8-thia-5-azatricyclo[7.4.0.02,7]trideca-1(9),2(7)-dien-5-yl}-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)methyl acetate 212b, compound 233a was obtained in 67% yield. LCMS: (M+H)+ 597

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b9295b92b7a541649832f20300289663
来源数据集: uspto-grants-2013_12
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08618107B2
来源说明: uspto-grants-2013_12

反应 SMILES

[C:1]([O:4][CH2:5][C:6]1[C:11]([N:12]2[C:24](=[O:25])[C:23]3[S:22][C:21]4[CH2:20][CH2:19][CH2:18][CH2:17][C:16]=4[C:15]=3[CH2:14][CH2:13]2)=[CH:10][C:9]([F:26])=[CH:8][C:7]=1[C:27]1[CH:32]=[C:31]([NH:33][C:34]2[CH:38]=C(C3CC3)N[N:35]=2)[C:30](=[O:42])[N:29]([CH3:43])[CH:28]=1)(=[O:3])[CH3:2].BrC1C=C(NC2C=[CH:58][C:57]([CH:60]3[CH2:63][N:62]([CH2:64][CH3:65])[CH2:61]3)=[CH:56]N=2)C(=O)N(C)C=1.C(OCC1C(B2OC(C)(C)C(C)(C)O2)=CC=CC=1N1C(=O)C2SC3CCCCC=3C=2CC1)(=O)C>>[C:1]([O:4][CH2:5][C:6]1[C:11]([N:12]2[C:24](=[O:25])[C:23]3[S:22][C:21]4[CH2:20][CH2:19][CH2:18][CH2:17][C:16]=4[C:15]=3[CH2:14][CH2:13]2)=[CH:10][C:9]([F:26])=[CH:8][C:7]=1[C:27]1[CH:32]=[C:31]([NH:33][C:34]2[CH:38]=[CH:58][C:57]([CH:60]3[CH2:63][N:62]([CH2:64][CH3:65])[CH2:61]3)=[CH:56][N:35]=2)[C:30](=[O:42])[N:29]([CH3:43])[CH:28]=1)(=[O:3])[CH3:2]