HRID678525

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID8071

未命名化合物

HCID19660

Carbonate

CO3-2

HCID80531

4,6-Dichloropyrimidine methyl sulphide

C5H4Cl2N2S

HCID104967

Cesium(1+)

Cs+

2 次

HCID2734368

2-Methoxy-5-pyridineboronic acid

C6H8BNO3

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

HCID57636137

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3b4ea2716b6b42668fc481d2757e57e8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[C:22](=[O:23])([O-:24])[O-:25].[CH3:1][O:2][c:3]1[n:4][cH:5][c:6]([B:9]([OH:10])[OH:11])[cH:7][cH:8]1.[CH3:28][O:29][CH2:30][CH2:31][O:32][CH3:33].[Cl:12][c:13]1[n:14][c:15]([S:20][CH3:21])[n:16][c:17]([Cl:19])[cH:18]1.[Cs+:26].[Cs+:27].[OH2:34].[cH:35]1[cH:36][cH:37][c:38]([P:39]([Pd:40]([P:41]([c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)([c:48]2[cH:49][cH:50][cH:51][cH:52][cH:53]2)[c:54]2[cH:55][cH:56][cH:57][cH:58][cH:59]2)([P:60]([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)[c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)[P:79]([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)[c:92]2[cH:93][cH:94][cH:95][cH:96][cH:97]2)([c:98]2[cH:99][cH:100][cH:101][cH:102][cH:103]2)[c:104]2[cH:105][cH:106][cH:107][cH:108][cH:109]2)[cH:110][cH:111]1>>[CH3:1][O:2][c:3]1[n:4][cH:5][c:6](-[c:17]2[n:16][c:15]([S:20][CH3:21])[n:14][c:13]([Cl:12])[cH:18]2)[cH:7][cH:8]1