HRID1214122

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID2734378

Pyridine-3-boronic acid

C5H6BNO2

结构：O=S(=O)(Oc1ccc(-c2nc3ccccc3o2)cc1Cl)C(F)(F)F

HCID21990962

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

HCID10125602

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ed8aa0d81a1f462aafd3b52179b2d66a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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