HRID1149790

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：Cc1cc(-c2ccc(C(F)(F)F)c(C)c2)nc(-c2cccc(Br)c2)n1

HCID57468770

未命名化合物

结构：CC(C)(C)NS(=O)(=O)c1ccc(B2OC(C)(C)C(C)(C)O2)s1

HCID57468817

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(-c2ccc(C(F)(F)F)c(C)c2)nc(-c2cccc(-c3ccc(S(=O)(=O)NC(C)(C)C)s3)c2)n1

HCID57469109

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d211bbfcfa64426ba469916a62e880c1
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

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