HRID671909

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID6367

Acetyl chloride

C2H3ClO

HCID31275

1,4-Dioxane

C4H8O2

结构：CC(C)(C)c1ccc(S(=O)(=O)Nc2cc(Cl)cnc2C(=O)c2cccc(N)n2)cc1

HCID57942125

未命名化合物

PRODUCTS

生成物

结构：CC(=O)Nc1cccc(C(=O)c2ncc(Cl)cc2NS(=O)(=O)c2ccc(C(C)(C)C)cc2)n1

HCID57942181

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1a75d64588d44fc8ae1037d31682d4ae
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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