HRID1233672

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

HCID813

Potassium cation

K+

HCID10934

Thiazole, 2,4-dimethyl-

C5H7NS

HCID11776

Triphenylphosphine

C18H15P

4 次

HCID23938

Palladium

HCID31374

Dimethylacetamide

C4H9NO

HCID101293

2-Bromo-5-nitroanisole

C7H6BrNO3

PRODUCTS

生成物

HCID67096129

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-cd2f420c2c6d439ba5ce254e022aac0e
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

[Br:1][c:2]1[c:3]([O:11][CH3:12])[cH:4][c:5]([N+:8](=[O:9])[O-:10])[cH:6][cH:7]1.[CH3:14][C:15](=[O:16])[O-:17].[CH3:18][c:19]1[s:20][cH:21][c:22]([CH3:24])[n:23]1.[CH3:25][N:26]([CH3:27])[C:28](=[O:29])[CH3:30].[K+:13].[Pd:31].[c:32]1([P:33]([c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[cH:46][cH:47][cH:48][cH:49][cH:50]1.[c:51]1([P:52]([c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)[c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)[cH:65][cH:66][cH:67][cH:68][cH:69]1.[c:70]1([P:71]([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)[cH:84][cH:85][cH:86][cH:87][cH:88]1.[c:89]1([P:90]([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)[cH:103][cH:104][cH:105][cH:106][cH:107]1>>[c:2]1(-[c:21]2[s:20][c:19]([CH3:18])[n:23][c:22]2[CH3:24])[c:3]([O:11][CH3:12])[cH:4][c:5]([N+:8](=[O:9])[O-:10])[cH:6][cH:7]1