HRID2145128

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID19660

Carbonate

CO3-2

HCID23938

Palladium

2 次

HCID95417

1,5-Diphenyl-1,4-pentadien-3-one

C17H14O

3 次

HCID104967

Cesium(1+)

Cs+

2 次

HCID67236171

未命名化合物

HCID67257034

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(N)cc(-c2cnc(C(C)(C)S(N)(=O)=O)s2)c1

HCID58456388

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-26bf728bd76f41f2bf35c87a6db19685
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[Br:1][c:2]1[cH:3][n:4][c:5]([C:7]([CH3:8])([CH3:9])[S:10](=[O:11])(=[O:12])[NH2:13])[s:6]1.[C:31](=[O:32])([O-:33])[O-:34].[CH3:14][c:15]1[cH:16][c:17]([NH2:18])[cH:19][c:20]([B:22]2[O:23][C:24]([CH3:25])([CH3:26])[C:27]([CH3:28])([CH3:29])[O:30]2)[cH:21]1.[CH:39](=[CH:40][C:41]([CH:42]=[CH:43][c:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1)=[O:50])[c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[CH:57](=[CH:58][C:59]([CH:60]=[CH:61][c:62]1[cH:63][cH:64][cH:65][cH:66][cH:67]1)=[O:68])[c:69]1[cH:70][cH:71][cH:72][cH:73][cH:74]1.[CH:75](=[CH:76][C:77]([CH:78]=[CH:79][c:80]1[cH:81][cH:82][cH:83][cH:84][cH:85]1)=[O:86])[c:87]1[cH:88][cH:89][cH:90][cH:91][cH:92]1.[Cs+:35].[Cs+:36].[Pd:37].[Pd:38]>>[c:2]1(-[c:20]2[cH:19][c:17]([NH2:18])[cH:16][c:15]([CH3:14])[cH:21]2)[cH:3][n:4][c:5]([C:7]([CH3:8])([CH3:9])[S:10](=[O:11])(=[O:12])[NH2:13])[s:6]1