HRID2137932

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID6344

Dichloromethane

CH2Cl2

HCID8028

Tetrahydrofuran

C4H8O

HCID65578

Ethanedioyl dichloride

C2Cl2O2

HCID517213

Isopropoxyacetic acid

C5H10O3

结构：CC(C)(C)c1ccc(S(=O)(=O)Nc2ccc(Cl)cc2C(=O)NN)cc1

HCID59302988

未命名化合物

PRODUCTS

生成物

结构：CC(C)OCC(=O)NNC(=O)c1cc(Cl)ccc1NS(=O)(=O)c1ccc(C(C)(C)C)cc1

HCID66905607

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-cb3ca287ab784c33b166a32322ca9f40
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

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