HRID2134334

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID23938

Palladium

2 次

HCID31275

1,4-Dioxane

C4H8O2

HCID95417

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

C17H14O

3 次

结构：CCC[CH2][Sn]([CH2]CCC)([CH2]CCC)[c]1cncnc1

HCID2763249

5-(Tributylstannyl)pyrimidine

C16H30N2Sn

HCID57475633

未命名化合物

PRODUCTS

生成物

结构：COc1ccc2oc3ccc(-c4cncnc4)cc3c(=O)c2c1

HCID57475654

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-42acd95832f74c9f99bbcd6fc7fbf98e
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:20][c:21]1[cH:22][c:23]2[c:24](=[O:37])[c:25]3[cH:26][c:27]([O:35][CH3:36])[cH:28][cH:29][c:30]3[o:31][c:32]2[cH:33][cH:34]1.[CH2:1]([Sn:2]([CH2:3][CH2:4][CH2:5][CH3:12])([c:6]1[cH:7][n:8][cH:9][n:10][cH:11]1)[CH2:13][CH2:14][CH2:15][CH3:16])[CH2:17][CH2:18][CH3:19].[O:40]=[C:41]([CH:42]=[CH:43][c:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1)[CH:50]=[CH:51][c:52]1[cH:53][cH:54][cH:55][cH:56][cH:57]1.[O:58]=[C:59]([CH:60]=[CH:61][c:62]1[cH:63][cH:64][cH:65][cH:66][cH:67]1)[CH:68]=[CH:69][c:70]1[cH:71][cH:72][cH:73][cH:74][cH:75]1.[O:76]=[C:77]([CH:78]=[CH:79][c:80]1[cH:81][cH:82][cH:83][cH:84][cH:85]1)[CH:86]=[CH:87][c:88]1[cH:89][cH:90][cH:91][cH:92][cH:93]1.[O:94]1[CH2:95][CH2:96][O:97][CH2:98][CH2:99]1.[Pd:38].[Pd:39]>>[c:6]1(-[c:21]2[cH:22][c:23]3[c:24](=[O:37])[c:25]4[cH:26][c:27]([O:35][CH3:36])[cH:28][cH:29][c:30]4[o:31][c:32]3[cH:33][cH:34]2)[cH:7][n:8][cH:9][n:10][cH:11]1