HRID110947

反应详情

EQUATION

反应方程式

REACTANTS

反应物

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

HCID136786

2-Pentyne, 4,4-dimethyl-

C7H12

HCID59129259

N-(2-Bromo-3-fluorophenyl)butanamide

C10H11BrFNO

PRODUCTS

产物

反应SMILES：CCCC(=O)Nc1cccc(F)c1C#CC(C)(C)C

HCID59129310

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-888f0c42427b4df9b866d1a7febdaee8
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[c:3]([NH:9][C:10]([CH2:11][CH2:12][CH3:13])=[O:14])[cH:4][cH:5][cH:6][c:7]1[F:8].[CH3:15][C:16]([C:17]#[C:18][CH3:19])([CH3:20])[CH3:21].[CH3:22][CH2:23][N:24]([CH2:25][CH3:26])[CH2:27][CH3:28].[Cu:29][I:30].[Pd:31]([Cl:32])[Cl:33].[c:34]1([P:35]([c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[cH:48][cH:49][cH:50][cH:51][cH:52]1.[c:53]1([P:54]([c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[cH:67][cH:68][cH:69][cH:70][cH:71]1>>[c:2]1([C:18]#[C:17][C:16]([CH3:15])([CH3:20])[CH3:21])[c:3]([NH:9][C:10]([CH2:11][CH2:12][CH3:13])=[O:14])[cH:4][cH:5][cH:6][c:7]1[F:8]