HRID167980

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11205

Carbon tetrabromide

CBr4

HCID11776

Triphenylphosphine

C18H15P

结构：O=C(NC1(CO)CC1)NC(Cc1ccccc1)(c1ccc(F)cc1)c1cc(F)cc(OC(F)(F)C(F)F)c1

HCID74065173

未命名化合物

PRODUCTS

生成物

结构：O=C(NC1(CBr)CC1)NC(Cc1ccccc1)(c1ccc(F)cc1)c1cc(F)cc(OC(F)(F)C(F)F)c1

HCID72456914

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e1a5fceb3f2445e3aab3e24b9edc36c7
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:58][C:59]([Br:60])([Br:61])[Br:62].[F:1][c:2]1[cH:3][c:4]([C:15]([CH2:16][c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)([c:23]2[cH:24][cH:25][c:26]([F:29])[cH:27][cH:28]2)[NH:30][C:31](=[O:32])[NH:33][C:34]2([CH2:37][OH:38])[CH2:35][CH2:36]2)[cH:5][c:6]([O:8][C:9]([CH:10]([F:11])[F:12])([F:13])[F:14])[cH:7]1.[c:39]1([P:40]([c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)[cH:53][cH:54][cH:55][cH:56][cH:57]1>>[F:1][c:2]1[cH:3][c:4]([C:15]([CH2:16][c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)([c:23]2[cH:24][cH:25][c:26]([F:29])[cH:27][cH:28]2)[NH:30][C:31](=[O:32])[NH:33][C:34]2([CH2:37][Br:58])[CH2:35][CH2:36]2)[cH:5][c:6]([O:8][C:9]([CH:10]([F:11])[F:12])([F:13])[F:14])[cH:7]1