HRID93266

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID12286

3-Bromopyridine

C5H4BrN

HCID23938

Palladium

HCID80271

Phosphine, tris(2-methylphenyl)-

C21H21P

HCID178435482

未命名化合物

PRODUCTS

生成物

结构：C(=Cc1ccc2c(c1)COC(NC1CCc3ccccc31)=N2)c1cccnc1

HCID178435484

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1d371455df9c4a00a5ad1d4d179664fb
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[Br:23][c:24]1[cH:25][n:26][cH:27][cH:28][cH:29]1.[CH3:52][CH2:53][N:54]([CH2:55][CH3:56])[CH2:57][CH3:58].[CH3:59][N:60]([CH3:61])[CH:62]=[O:63].[CH:1]1([NH:10][C:11]2=[N:16][c:15]3[c:14]([cH:20][c:19]([CH:21]=[CH2:22])[cH:18][cH:17]3)[CH2:13][O:12]2)[CH2:2][CH2:3][c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]21.[OH2:65].[Pd:64].[c:30]1([CH3:31])[cH:32][cH:33][cH:34][cH:35][c:36]1[P:37]([c:38]1[cH:39][cH:40][cH:41][cH:42][c:43]1[CH3:44])[c:45]1[cH:46][cH:47][cH:48][cH:49][c:50]1[CH3:51]>>[CH:1]1([NH:10][C:11]2=[N:16][c:15]3[c:14]([cH:20][c:19]([CH:21]=[CH:22][c:24]4[cH:25][n:26][cH:27][cH:28][cH:29]4)[cH:18][cH:17]3)[CH2:13][O:12]2)[CH2:2][CH2:3][c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]21