HRID164089

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

结构：O=C(O)c1ccc(Br)cc1NS(=O)(=O)c1cccc2nccnc12

HCID11429708

未命名化合物

HCID43197809

2,4-Difluoro-α-(trifluoromethyl)benzenemethanamine

C8H6F5N

PRODUCTS

生成物

结构：O=C(NC(c1ccc(F)cc1F)C(F)(F)F)c1ccc(Br)cc1NS(=O)(=O)c1cccc2nccnc12

HCID72769240

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-57e060edb6444a1683d672b0c801b4b8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[Br:1][c:2]1[cH:3][c:4]([NH:11][S:12](=[O:13])(=[O:14])[c:15]2[c:16]3[n:17][cH:18][cH:19][n:20][c:21]3[cH:22][cH:23][cH:24]2)[c:5]([C:6](=[O:7])[OH:8])[cH:9][cH:10]1.[ClH:25].[F:26][c:27]1[c:28]([CH:34]([C:35]([F:36])([F:37])[F:38])[NH2:39])[cH:29][cH:30][c:31]([F:33])[cH:32]1>>[Br:1][c:2]1[cH:3][c:4]([NH:11][S:12](=[O:13])(=[O:14])[c:15]2[c:16]3[n:17][cH:18][cH:19][n:20][c:21]3[cH:22][cH:23][cH:24]2)[c:5]([C:6](=[O:7])[NH:39][CH:34]([c:28]2[c:27]([F:26])[cH:32][c:31]([F:33])[cH:30][cH:29]2)[C:35]([F:36])([F:37])[F:38])[cH:9][cH:10]1