HRID2319018

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID137761

2-Fluorobenzenesulphonyl chloride

C6H4ClFO2S

结构：CC(C)CC(NC(=O)OC(C)(C)C)C(=O)NC1CCCNCC1O

HCID22980187

未命名化合物

PRODUCTS

生成物

结构：CC(C)CC(NC(=O)OC(C)(C)C)C(=O)NC1CCCN(S(=O)(=O)c2ccccc2F)CC1O

HCID178446777

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1cc830106ead46fb80d502c749e246b1
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

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