HRID88319

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8021

Diethylamine

C4H11N

HCID8028

Tetrahydrofuran

C4H8O

HCID24350

Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)

CuI

HCID90364

2-Bromo-3-methoxypyridine

C6H6BrNO

结构：C#CCOCCCCCCN(Cc1ccccc1)CC(O)c1cc(Cl)c(N)c(Cl)c1

HCID20062846

未命名化合物

PRODUCTS

生成物

结构：COc1cccnc1C#CCOCCCCCCN(Cc1ccccc1)CC(O)c1cc(Cl)c(N)c(Cl)c1

HCID23045060

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3ee9b4f9bca3482aa1dde16d555d3b4b
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:1][c:2]1[n:3][cH:4][cH:5][cH:6][c:7]1[O:8][CH3:9].[CH2:40]([NH:41][CH2:42][CH3:43])[CH3:44].[CH2:45]1[O:46][CH2:47][CH2:48][CH2:49]1.[Cu:50][I:51].[NH2:10][c:11]1[c:12]([Cl:39])[cH:13][c:14]([CH:18]([OH:19])[CH2:20][N:21]([CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][O:28][CH2:29][C:30]#[CH:31])[CH2:32][c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)[cH:15][c:16]1[Cl:17]>>[c:2]1([C:31]#[C:30][CH2:29][O:28][CH2:27][CH2:26][CH2:25][CH2:24][CH2:23][CH2:22][N:21]([CH2:20][CH:18]([c:14]2[cH:13][c:12]([Cl:39])[c:11]([NH2:10])[c:16]([Cl:17])[cH:15]2)[OH:19])[CH2:32][c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)[n:3][cH:4][cH:5][cH:6][c:7]1[O:8][CH3:9]