HRID1123332

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID7037

Benzhydrol

C13H12O

结构：O=S(=O)(Cl)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

HCID520945

3,5-Bis(trifluoromethyl)benzenesulphonyl chloride

C8H3ClF6O2S

HCID15291669

未命名化合物

PRODUCTS

生成物

结构：O=C(O)c1ccccc1Oc1ccc(C(F)(F)F)cc1NS(=O)(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

HCID9808192

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c3eb0c4c95304abca5a649b85661eb7f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[CH:22]([OH:23])([c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)[c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1.[F:36][C:37]([c:38]1[cH:39][c:40]([S:48](=[O:49])(=[O:50])[Cl:51])[cH:41][c:42]([C:44]([F:45])([F:46])[F:47])[cH:43]1)([F:52])[F:53].[NH2:1][c:2]1[c:3]([O:4][c:5]2[c:6]([C:7](=[O:8])[OH:9])[cH:10][cH:11][cH:12][cH:13]2)[cH:14][cH:15][c:16]([C:18]([F:19])([F:20])[F:21])[cH:17]1.[cH:54]1[cH:55][cH:56][n:57][cH:58][cH:59]1>>[NH:1]([c:2]1[c:3]([O:4][c:5]2[c:6]([C:7](=[O:8])[OH:9])[cH:10][cH:11][cH:12][cH:13]2)[cH:14][cH:15][c:16]([C:18]([F:19])([F:20])[F:21])[cH:17]1)[S:48]([c:40]1[cH:39][c:38]([C:37]([F:36])([F:52])[F:53])[cH:43][c:42]([C:44]([F:45])([F:46])[F:47])[cH:41]1)(=[O:49])=[O:50]