HRID2324955

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID31297

Methanesulfonyl chloride

CH3ClO2S

结构：COc1ccc(C2(C)CSc3cc(OC)ccc3C2CCCCCCCCO)cc1

HCID22033221

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(C2(C)CSc3cc(OC)ccc3C2CCCCCCCCOS(C)(=O)=O)cc1

HCID22033374

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-220cb19230674c2fa607fc197239e5b9
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

[CH3:31][CH2:32][N:33]([CH2:34][CH3:35])[CH2:36][CH3:37].[CH3:38][S:39]([Cl:40])(=[O:41])=[O:42].[Cl:44][CH2:45][Cl:46].[OH2:43].[OH:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH:10]1[C:11]([CH3:22])([c:23]2[cH:24][cH:25][c:26]([O:29][CH3:30])[cH:27][cH:28]2)[CH2:12][S:13][c:14]2[cH:15][c:16]([O:20][CH3:21])[cH:17][cH:18][c:19]21>>[O:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH:10]1[C:11]([CH3:22])([c:23]2[cH:24][cH:25][c:26]([O:29][CH3:30])[cH:27][cH:28]2)[CH2:12][S:13][c:14]2[cH:15][c:16]([O:20][CH3:21])[cH:17][cH:18][c:19]21)[S:39]([CH3:38])(=[O:41])=[O:42]