HRID88078

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID81531

Diisopropylethylamine

C8H19N

HCID392871

1-(tert-Butoxycarbonyl)-4-piperidinecarboxylic acid

C11H19NO4

HCID2740318

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC(C(=O)NS(=O)(=O)c2c(Cl)sc(Cl)c2Br)CC1

HCID11519258

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a52d6409f6e0487db707b46145c8efa1
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:14][c:15]1[c:16]([S:22](=[O:23])(=[O:24])[NH2:25])[c:17]([Cl:21])[s:18][c:19]1[Cl:20].[C:26]([CH3:27])([CH3:28])([CH3:29])[O:30][C:31](=[O:32])[N:33]1[CH2:34][CH2:35][CH:36]([C:39](=[O:40])[OH:41])[CH2:37][CH2:38]1.[CH2:10]([Cl:11])[CH2:12][Cl:13].[CH3:42][N:43]([c:44]1[cH:45][cH:46][n:47][cH:48][cH:49]1)[CH3:50].[CH:1]([N:2]([CH2:3][CH3:4])[CH:5]([CH3:6])[CH3:7])([CH3:8])[CH3:9].[O:51]=[CH:52][N:53]([CH3:54])[CH3:55]>>[Br:14][c:15]1[c:16]([S:22](=[O:23])(=[O:24])[NH:25][C:39]([CH:36]2[CH2:35][CH2:34][N:33]([C:31]([O:30][C:26]([CH3:27])([CH3:28])[CH3:29])=[O:32])[CH2:38][CH2:37]2)=[O:40])[c:17]([Cl:21])[s:18][c:19]1[Cl:20]