HRID826659

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID12543

Benzenesulfonamide, N,4-dimethyl-

C8H11NO2S

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

结构：COc1nnc(-c2ccncc2)cc1-c1cc2ccc(Br)cc2n1C(=O)OC(C)(C)C

HCID68637361

未命名化合物

PRODUCTS

生成物

结构：COc1nnc(-c2ccncc2)cc1-c1cc2ccc(N(C)S(=O)(=O)c3ccc(C)cc3)cc2n1C(=O)OC(C)(C)C

HCID68637032

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-541a5db3dd964fe38c3b3ac91b8f5286
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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