HRID2162398

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID13387

N-Methyl-2-pyrrolidone

C5H9NO

HCID24350

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

CuI

HCID28179

Fluoride

F-

HCID4204914

Triethyl(trifluoromethyl)silane

C7H15F3Si

结构：CC1(C)C(=O)NC(=O)N1CCNc1nccc(-c2sccc2I)n1

HCID60204526

未命名化合物

PRODUCTS

生成物

结构：CC1(C)C(=O)NC(=O)N1CCNc1nccc(-c2sccc2C(F)(F)F)n1

HCID60204534

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-334cee510afd45dfa5f962dd8547146d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[CH2:27]([Si:28]([CH2:29][CH3:34])([C:30]([F:31])([F:32])[F:33])[CH2:35][CH3:36])[CH3:37].[CH3:48][N:49]1[CH2:50][CH2:51][CH2:52][C:53]1=[O:54].[Cl:43][CH2:44][Cl:45].[Cu:46][I:47].[F-:25].[I:1][c:2]1[c:3](-[c:7]2[n:8][c:9]([NH:13][CH2:14][CH2:15][N:16]3[C:17](=[O:24])[NH:18][C:19](=[O:23])[C:20]3([CH3:21])[CH3:22])[n:10][cH:11][cH:12]2)[s:4][cH:5][cH:6]1.[K+:26].[O:38]=[CH:39][N:40]([CH3:41])[CH3:42]>>[c:2]1([C:30]([F:31])([F:32])[F:33])[c:3](-[c:7]2[n:8][c:9]([NH:13][CH2:14][CH2:15][N:16]3[C:17](=[O:24])[NH:18][C:19](=[O:23])[C:20]3([CH3:21])[CH3:22])[n:10][cH:11][cH:12]2)[s:4][cH:5][cH:6]1