HRID145081

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID31275

1,4-Dioxane

C4H8O2

HCID73277

Chloropyrazine

C4H3ClN2

HCID104815

Cuprous ion

Cu+

结构：CC(C)(C)OC(=O)Nc1cccc[c]1[Sn]([CH3])([CH3])[CH3]

HCID10155176

tert-Butyl [2-(trimethylstannyl)phenyl]carbamate

C14H23NO2Sn

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

HCID22493234

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-733b93a1649e41b08faea692cbcbacc6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[c:9]([Sn:14]([CH3:15])([CH3:16])[CH3:17])[cH:10][cH:11][cH:12][cH:13]1)=[O:18].[CH2:26]1[O:27][CH2:28][CH2:29][O:30][CH2:31]1.[Cl:19][c:20]1[n:21][cH:22][cH:23][n:24][cH:25]1.[Cu+:109].[cH:32]1[cH:33][cH:34][c:35]([P:36]([Pd:37]([P:38]([c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)([c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)[c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)([P:57]([c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)([c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)[c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)[P:76]([c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)([c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)[c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)([c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)[c:101]2[cH:102][cH:103][cH:104][cH:105][cH:106]2)[cH:107][cH:108]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[c:9](-[c:20]2[n:21][cH:22][cH:23][n:24][cH:25]2)[cH:10][cH:11][cH:12][cH:13]1)=[O:18]