HRID954499

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID962

Water

H2O

2 次

HCID8071

未命名化合物

HCID2779353

3-Fluoropyridine-4-boronic acid

C5H5BFNO2

结构：CN(Cc1cc(Br)n(S(=O)(=O)c2cccnc2)c1)C(=O)OC(C)(C)C

HCID57522258

未命名化合物

结构：c1ccc([PH](c2ccccc2)(c2ccccc2)[Pd]([PH](c2ccccc2)(c2ccccc2)c2ccccc2)([PH](c2ccccc2)(c2ccccc2)c2ccccc2)[PH](c2ccccc2)(c2ccccc2)c2ccccc2)cc1

HCID178420554

未命名化合物

PRODUCTS

生成物

结构：CN(Cc1cc(-c2ccncc2F)n(S(=O)(=O)c2cccnc2)c1)C(=O)OC(C)(C)C

HCID66974615

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8c426d140b5e439a9025caba670c37e0
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([N:7]([CH3:8])[CH2:9][c:10]1[cH:11][n:12]([S:16](=[O:17])(=[O:18])[c:19]2[cH:20][n:21][cH:22][cH:23][cH:24]2)[c:13]([Br:15])[cH:14]1)=[O:25].[CH3:42][O:43][CH2:44][CH2:45][O:46][CH3:47].[F:27][c:28]1[cH:29][n:30][cH:31][cH:32][c:33]1[B:34]([OH:35])[OH:36].[Na+:37].[OH2:125].[OH2:26].[OH:38][C:39](=[O:40])[O-:41].[cH:48]1[cH:49][cH:50][c:51]([P:52]([Pd:53]([P:54]([c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)([c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[c:67]2[cH:68][cH:69][cH:70][cH:71][cH:72]2)([P:73]([c:74]2[cH:75][cH:76][cH:77][cH:78][cH:79]2)([c:80]2[cH:81][cH:82][cH:83][cH:84][cH:85]2)[c:86]2[cH:87][cH:88][cH:89][cH:90][cH:91]2)[P:92]([c:93]2[cH:94][cH:95][cH:96][cH:97][cH:98]2)([c:99]2[cH:100][cH:101][cH:102][cH:103][cH:104]2)[c:105]2[cH:106][cH:107][cH:108][cH:109][cH:110]2)([c:111]2[cH:112][cH:113][cH:114][cH:115][cH:116]2)[c:117]2[cH:118][cH:119][cH:120][cH:121][cH:122]2)[cH:123][cH:124]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([N:7]([CH3:8])[CH2:9][c:10]1[cH:11][n:12]([S:16](=[O:17])(=[O:18])[c:19]2[cH:20][n:21][cH:22][cH:23][cH:24]2)[c:13](-[c:33]2[c:28]([F:27])[cH:29][n:30][cH:31][cH:32]2)[cH:14]1)=[O:25]