HRID690334

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6212

Chloroform

CHCl3

HCID6422

未命名化合物

结构：CC(C)(C)OC(=O)NC(Cc1cccc(OC(F)(F)C(F)F)c1)C(O)c1csc(-c2ccccc2)n1

HCID86593308

未命名化合物

PRODUCTS

生成物

结构：NC(Cc1cccc(OC(F)(F)C(F)F)c1)C(O)c1csc(-c2ccccc2)n1

HCID22261593

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c773932cfffb4ffc945579fb07e92919
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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