HRID144946

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7502

4-Vinylpyridine

C7H7N

HCID8471

Triethylamine

C6H15N

HCID80271

Phosphine, tris(2-methylphenyl)-

C21H21P

结构：COc1cc(Nc2c(C#N)cnc3cc(Br)ccc23)c(Cl)cc1Cl

HCID23438214

未命名化合物

PRODUCTS

生成物

结构：COc1cc(Nc2c(C#N)cnc3cc(C=Cc4ccncc4)ccc23)c(Cl)cc1Cl

HCID68555973

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5530fdcb558f49fcaac0b3297ce582fd
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

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