HRID2338408

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

HCID24350

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

CuI

HCID57845328

未命名化合物

HCID63867546

未命名化合物

PRODUCTS

生成物

结构：Clc1ccc(-c2ccc(C#Cc3cnc(OCCN4CCCC4)nc3)nc2)cc1

HCID10046847

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d8c7934a1c9f4b9cb943d485b339c2d9
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

[Br:23][c:24]1[cH:25][n:26][c:27]([O:30][CH2:31][CH2:32][N:33]2[CH2:34][CH2:35][CH2:36][CH2:37]2)[n:28][cH:29]1.[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[Cl:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][cH:17][c:18]([C:21]#[CH:22])[n:19][cH:20]2)[cH:13][cH:14]1.[Cu:44][I:45].[O:38]=[CH:39][N:40]([CH3:41])[CH3:42].[OH2:43]>>[Cl:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][cH:17][c:18]([C:21]#[C:22][c:24]3[cH:25][n:26][c:27]([O:30][CH2:31][CH2:32][N:33]4[CH2:34][CH2:35][CH2:36][CH2:37]4)[n:28][cH:29]3)[n:19][cH:20]2)[cH:13][cH:14]1