HRID1135424

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID8082

Piperidine

C5H11N

HCID11575

Benzene, iodo-

C6H5I

结构：C#Cc1cccc(-c2c(Cc3ccccc3)cnc3c(C(F)(F)F)cccc23)c1

HCID86055589

未命名化合物

PRODUCTS

生成物

结构：FC(F)(F)c1cccc2c(-c3cccc(C#Cc4ccccc4)c3)c(Cc3ccccc3)cnc12

HCID66913916

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4ae4886de13c409e804a183997f35c82
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][n:10][c:11]2[c:12]([C:26]([F:27])([F:28])[F:29])[cH:13][cH:14][cH:15][c:16]2[c:17]1-[c:18]1[cH:19][c:20]([C:24]#[CH:25])[cH:21][cH:22][cH:23]1.[CH2:37]1[CH2:38][CH2:39][NH:40][CH2:41][CH2:42]1.[CH3:43][c:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1.[I:30][c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][n:10][c:11]2[c:12]([C:26]([F:27])([F:28])[F:29])[cH:13][cH:14][cH:15][c:16]2[c:17]1-[c:18]1[cH:19][c:20]([C:24]#[C:25][c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[cH:21][cH:22][cH:23]1