HRID1209830

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8857

Ethyl acetate

C4H8O2

HCID31275

1,4-Dioxane

C4H8O2

结构：CCC[CH2][Sn]([CH2]CCC)([CH2]CCC)[c]1cccs1

HCID2779373

2-(Tributylstannyl)thiophene

C16H30SSn

HCID10352723

2-Chloro-5-nitrobenzo[d]oxazole

C7H3ClN2O3

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

HCID11253621

Benzoxazole, 5-nitro-2-(2-thienyl)-

C11H6N2O3S

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8ca6766fa61445378432a46050b86b97
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[CH2:14]([Sn:15]([CH2:16][CH2:17][CH2:18][CH3:24])([c:19]1[s:20][cH:21][cH:22][cH:23]1)[CH2:25][CH2:26][CH2:27][CH3:28])[CH2:29][CH2:30][CH3:31].[CH3:32][CH2:33][O:34][C:35](=[O:36])[CH3:37].[Cl:1][c:2]1[o:3][c:4]2[c:5]([n:6]1)[cH:7][c:8]([N+:11](=[O:12])[O-:13])[cH:9][cH:10]2.[O:38]1[CH2:39][CH2:40][O:41][CH2:42][CH2:43]1.[cH:44]1[cH:45][cH:46][c:47]([P:48]([Pd:49]([P:50]([c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)([c:57]2[cH:58][cH:59][cH:60][cH:61][cH:62]2)[c:63]2[cH:64][cH:65][cH:66][cH:67][cH:68]2)([P:69]([c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)([c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)[c:82]2[cH:83][cH:84][cH:85][cH:86][cH:87]2)[P:88]([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)([c:107]2[cH:108][cH:109][cH:110][cH:111][cH:112]2)[c:113]2[cH:114][cH:115][cH:116][cH:117][cH:118]2)[cH:119][cH:120]1>>[c:2]1(-[c:19]2[s:20][cH:21][cH:22][cH:23]2)[o:3][c:4]2[c:5]([n:6]1)[cH:7][c:8]([N+:11](=[O:12])[O-:13])[cH:9][cH:10]2