HRID1568275

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8471

Triethylamine

C6H15N

HCID11776

Triphenylphosphine

C18H15P

HCID24350

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

CuI

HCID123086

Benzene, 1-chloro-3-ethynyl-

C8H5Cl

HCID66865685

未命名化合物

PRODUCTS

生成物

结构：Cc1nc(C#Cc2cccc(Cl)c2)cn1-c1cnn(C)c(=O)c1

HCID49872767

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-676cac0d9b67486eaf9d23f5e83cca11
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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