HRID104471

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2737811

4-Carbamoylphenylboronic acid

C7H8BNO3

结构：Brc1cnc(Nc2ccc(-n3cc(-c4ccccn4)nn3)cc2)c2nccn12

HCID59023107

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：NC(=O)c1ccc(-c2cnc(Nc3ccc(-n4cc(-c5ccccn5)nn4)cc3)c3nccn23)cc1

HCID17757332

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4f031d73b8154ff18fb0c914fedc3e56
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[Br:1][c:2]1[cH:3][n:4][c:5]([NH:11][c:12]2[cH:13][cH:14][c:15](-[n:18]3[n:19][n:20][c:21](-[c:23]4[n:24][cH:25][cH:26][cH:27][cH:28]4)[cH:22]3)[cH:16][cH:17]2)[c:6]2[n:7]1[cH:8][cH:9][n:10]2.[NH2:29][C:30](=[O:31])[c:32]1[cH:33][cH:34][c:35]([B:38]([OH:39])[OH:40])[cH:36][cH:37]1.[cH:41]1[cH:42][cH:43][c:44]([P:45]([Pd:46]([P:47]([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)[c:60]2[cH:61][cH:62][cH:63][cH:64][cH:65]2)([P:66]([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)[c:79]2[cH:80][cH:81][cH:82][cH:83][cH:84]2)[P:85]([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)[c:110]2[cH:111][cH:112][cH:113][cH:114][cH:115]2)[cH:116][cH:117]1>>[c:2]1(-[c:35]2[cH:34][cH:33][c:32]([C:30]([NH2:29])=[O:31])[cH:37][cH:36]2)[cH:3][n:4][c:5]([NH:11][c:12]2[cH:13][cH:14][c:15](-[n:18]3[n:19][n:20][c:21](-[c:23]4[n:24][cH:25][cH:26][cH:27][cH:28]4)[cH:22]3)[cH:16][cH:17]2)[c:6]2[n:7]1[cH:8][cH:9][n:10]2