HRID1561845

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID260

Hydrogen Bromide

BrH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID43600

5-bromothiazol-2-amine

C3H3BrN2S

HCID65578

Ethanedioyl dichloride

C2Cl2O2

结构：CS(=O)(=O)c1ccc(C(CC2CCCC2)C(=O)O)cc1

HCID12069489

未命名化合物

PRODUCTS

生成物

结构：CS(=O)(=O)c1ccc(C(CC2CCCC2)C(=O)Nc2ncc(Br)s2)cc1

HCID22315232

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a0a1a73f219a42cb8eeafd2d9646cde1
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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