HRID2332879

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8471

Triethylamine

C6H15N

HCID11776

Triphenylphosphine

C18H15P

HCID83717

Copper iodide (CuI2)

CuI2

HCID11474793

未命名化合物

HCID13337173

未命名化合物

PRODUCTS

生成物

结构：CCCCCCCCCCOc1cnc(-c2ccc(C#CCCCC(C)O)cc2)nc1

HCID19437556

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-819d5bd35d1f488fbcd00887d5c1a5d3
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

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