HRID2327831

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID24350

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

CuI

HCID66111

Trimethylsilylacetylene

C5H10Si

结构：O=c1c2ccccc2c2nc3ccccn3c2n1-c1ccc(Br)nc1

HCID24771093

未命名化合物

PRODUCTS

生成物

结构：C[Si](C)(C)C#Cc1ccc(-n2c(=O)c3ccccc3c3nc4ccccn4c32)cn1

HCID57767022

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-126b99f3e11d4662bb90a9d2e4198982
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:14][c:15]1[cH:16][cH:17][c:18](-[n:21]2[c:22](=[O:38])[c:23]3[cH:24][cH:25][cH:26][cH:27][c:28]3[c:29]3[c:30]2[n:31]2[c:32]([n:33]3)[cH:34][cH:35][cH:36][cH:37]2)[cH:19][n:20]1.[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[CH3:8][Si:9]([CH3:10])([CH3:11])[C:12]#[CH:13].[Cu:44][I:45].[O:39]=[CH:40][N:41]([CH3:42])[CH3:43]>>[CH3:8][Si:9]([CH3:10])([CH3:11])[C:12]#[C:13][c:15]1[cH:16][cH:17][c:18](-[n:21]2[c:22](=[O:38])[c:23]3[cH:24][cH:25][cH:26][cH:27][c:28]3[c:29]3[c:30]2[n:31]2[c:32]([n:33]3)[cH:34][cH:35][cH:36][cH:37]2)[cH:19][n:20]1