HRID196364

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID11776

Triphenylphosphine

C18H15P

2 次

HCID24290

未命名化合物

HCID24350

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

CuI

HCID88695

5-Iodo-1H-indole-2,3-dione

C8H4INO2

HCID10609355

未命名化合物

PRODUCTS

生成物

结构：O=C1Nc2ccc(C#CCCN3CCC(Cc4ccccc4)CC3)cc2C1=O

HCID10761824

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bc99119fd3834530a7594ec9caf162e9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH:8]1[CH2:9][CH2:10][N:11]([CH2:14][CH2:15][C:16]#[CH:17])[CH2:12][CH2:13]1.[CH3:18][CH2:19][N:20]([CH2:21][CH3:22])[CH2:23][CH3:24].[Cu:42][I:43].[I:25][c:26]1[cH:27][c:28]2[c:32]([cH:33][cH:34]1)[NH:31][C:30](=[O:35])[C:29]2=[O:36].[O:37]=[CH:38][N:39]([CH3:40])[CH3:41].[Pd:44]([Cl:45])[Cl:46].[c:47]1([P:48]([c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)[c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[cH:61][cH:62][cH:63][cH:64][cH:65]1.[c:66]1([P:67]([c:68]2[cH:69][cH:70][cH:71][cH:72][cH:73]2)[c:74]2[cH:75][cH:76][cH:77][cH:78][cH:79]2)[cH:80][cH:81][cH:82][cH:83][cH:84]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH:8]1[CH2:9][CH2:10][N:11]([CH2:14][CH2:15][C:16]#[C:17][c:26]2[cH:27][c:28]3[c:32]([cH:33][cH:34]2)[NH:31][C:30](=[O:35])[C:29]3=[O:36])[CH2:12][CH2:13]1