HRID290086

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID28486

Lithium ion

Li+

HCID166653

Hydride

H-

HCID4103526

tert-Butyl N-(2-bromoethyl)carbamate

C7H14BrNO2

HCID22400412

(1-Methoxyethyl)(trimethyl)silane

C6H16OSi

结构：Cc1ccc(F)cc1C1CC(=O)NC(c2cccc(Cl)c2)C12C(=O)Nc1cc(Cl)ccc12

HCID76568090

未命名化合物

PRODUCTS

生成物

HCID22400412

(1-Methoxyethyl)(trimethyl)silane

C6H16OSi

结构：Cc1ccc(F)cc1C1CC(=O)N(CCNC(=O)OC(C)(C)C)C(c2cccc(Cl)c2)C12C(=O)Nc1cc(Cl)ccc12

HCID77580097

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-966d3cb53bfb4abc82f32beae44e6a83
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[C:43]([CH3:44])([CH3:45])([CH3:46])[O:47][C:48]([NH:49][CH2:50][CH2:51][Br:52])=[O:53].[CH3:1][O:2][CH:3]([CH3:4])[Si:5]([CH3:6])([CH3:7])[CH3:8].[CH3:54][N:55]([CH3:56])[CH:57]=[O:58].[Cl:9][c:10]1[cH:11][cH:12][c:13]2[c:17]([cH:18]1)[NH:16][C:15](=[O:19])[C:14]21[CH:20]([c:34]2[cH:35][c:36]([Cl:40])[cH:37][cH:38][cH:39]2)[NH:21][C:22](=[O:33])[CH2:23][CH:24]1[c:25]1[c:26]([CH3:32])[cH:27][cH:28][c:29]([F:31])[cH:30]1.[H-:41].[Li+:42]>>[CH3:1][O:2][CH:3]([CH3:4])[Si:5]([CH3:6])([CH3:7])[CH3:8].[Cl:9][c:10]1[cH:11][cH:12][c:13]2[c:17]([cH:18]1)[NH:16][C:15](=[O:19])[C:14]21[CH:20]([c:34]2[cH:35][c:36]([Cl:40])[cH:37][cH:38][cH:39]2)[N:21]([CH2:51][CH2:50][NH:49][C:48]([O:47][C:43]([CH3:44])([CH3:45])[CH3:46])=[O:53])[C:22](=[O:33])[CH2:23][CH:24]1[c:25]1[c:26]([CH3:32])[cH:27][cH:28][c:29]([F:31])[cH:30]1