HRID2315183

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

结构：CCC[CH2][Sn]([CH2]CCC)([CH2]CCC)[c]1nccs1

HCID2763259

2-(Tributylstannyl)thiazole

C15H29NSSn

结构：CCc1cccc(CC)c1-c1cc2c(Br)cn(-c3ccc(C(C)C)cc3)c2cn1

HCID67152728

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：CCc1cccc(CC)c1-c1cc2c(-c3nccs3)cn(-c3ccc(C(C)C)cc3)c2cn1

HCID58269951

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ba54d09039eb4644a269c3dbdacd451d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[Br:1][c:2]1[cH:3][n:4](-[c:21]2[cH:22][cH:23][c:24]([CH:27]([CH3:28])[CH3:29])[cH:25][cH:26]2)[c:5]2[cH:6][n:7][c:8](-[c:11]3[c:12]([CH2:19][CH3:20])[cH:13][cH:14][cH:15][c:16]3[CH2:17][CH3:18])[cH:9][c:10]12.[CH2:30]([Sn:31]([CH2:32][CH2:33][CH2:34][CH3:40])([c:35]1[s:36][cH:37][cH:38][n:39]1)[CH2:41][CH2:42][CH2:43][CH3:44])[CH2:45][CH2:46][CH3:47].[CH3:53][CH2:54][O:55][C:56]([CH3:57])=[O:58].[O:48]=[CH:49][N:50]([CH3:51])[CH3:52].[cH:59]1[cH:60][cH:61][c:62]([P:63]([Pd:64]([P:65]([c:66]2[cH:67][cH:68][cH:69][cH:70][cH:71]2)([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)([P:84]([c:85]2[cH:86][cH:87][cH:88][cH:89][cH:90]2)([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)[P:103]([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)[c:116]2[cH:117][cH:118][cH:119][cH:120][cH:121]2)([c:122]2[cH:123][cH:124][cH:125][cH:126][cH:127]2)[c:128]2[cH:129][cH:130][cH:131][cH:132][cH:133]2)[cH:134][cH:135]1>>[c:2]1(-[c:35]2[s:36][cH:37][cH:38][n:39]2)[cH:3][n:4](-[c:21]2[cH:22][cH:23][c:24]([CH:27]([CH3:28])[CH3:29])[cH:25][cH:26]2)[c:5]2[cH:6][n:7][c:8](-[c:11]3[c:12]([CH2:19][CH3:20])[cH:13][cH:14][cH:15][c:16]3[CH2:17][CH3:18])[cH:9][c:10]12