HRID2319573

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID1140

Toluene

C7H8

HCID23938

Palladium

HCID95417

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

C17H14O

HCID2125344

4-Morpholin-4-ylmethyl-thiazol-2-ylamine

C8H13N3OS

HCID4574913

未命名化合物

HCID49758022

5,8-Dibromo[1,2,4]triazolo[1,5-a]pyrazine

C5H2Br2N4

PRODUCTS

生成物

HCID57541337

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-71bd1ae713834bfe9ed42a007949eb51
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:5]([Br:11])[c:6]2[n:7]1[n:8][cH:9][n:10]2.[CH3:25][C:26]([CH3:27])([O-:28])[CH3:29].[CH3:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[CH:38](=[CH:39][C:40]([CH:41]=[CH:42][c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1)=[O:49])[c:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1.[Na+:30].[O:12]1[CH2:13][CH2:14][N:15]([CH2:18][c:19]2[n:20][c:21]([NH2:24])[s:22][cH:23]2)[CH2:16][CH2:17]1.[Pd:56]>>[Br:1][c:2]1[cH:3][n:4][c:5]([NH:24][c:21]2[n:20][c:19]([CH2:18][N:15]3[CH2:14][CH2:13][O:12][CH2:17][CH2:16]3)[cH:23][s:22]2)[c:6]2[n:7]1[n:8][cH:9][n:10]2