HRID2122534

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

3 次

HCID8471

Triethylamine

C6H15N

HCID31297

Methanesulfonyl chloride

CH3ClO2S

结构：CCC(CC)(c1ccc(N)c(C)c1)c1ccc(OCC(=O)C(C)(C)C)c(C)c1

HCID68452943

未命名化合物

PRODUCTS

生成物

结构：CCC(CC)(c1ccc(NS(C)(=O)=O)c(C)c1)c1ccc(OCC(=O)C(C)(C)C)c(C)c1

HCID11224956

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d6f2a24c72f8409481e3cbd0443a2e4d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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