HRID2346349

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID28486

Lithium ion

Li+

HCID31297

Methanesulfonyl chloride

CH3ClO2S

结构：NS(=O)(=O)c1ccc(-c2oc(CO)nc2-c2ccccc2)cc1

HCID22246243

未命名化合物

PRODUCTS

生成物

结构：NS(=O)(=O)c1ccc(-c2oc(CCl)nc2-c2ccccc2)cc1

HCID22246345

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e391aa4ac5064809af375de4428b2544
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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