HRID959923

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID260

Hydrogen Bromide

BrH

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID8857

Ethyl acetate

C4H8O2

HCID81531

Diisopropylethylamine

C8H19N

HCID519494

Methyl 2-isocyanatobenzoate

C9H7NO3

HCID3530572

1-Tert-butylpiperazine

C8H18N2

PRODUCTS

生成物

结构：COC(=O)c1ccccc1NC(=O)N1CCN(C(C)(C)C)CC1

HCID21906314

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7384e10dc95744ca94876dc0341e2f24
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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