HRID286289

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID8028

Tetrahydrofuran

C4H8O

HCID166653

Hydride

H-

HCID230685

Ethyl N-(4-methylbenzene-1-sulfonyl)glycinate

C11H15NO4S

结构：CCOC(=O)c1c(Br)c(Br)n(Cc2ccc(F)cc2)c1CBr

HCID53237464

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)CN(Cc1c(C(=O)OCC)c(Br)c(Br)n1Cc1ccc(F)cc1)S(=O)(=O)c1ccc(C)cc1

HCID59855815

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-20c15b0a1e6440c08561303650ca8929
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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