HRID111221

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID6378

(+/-)-1,2-Propylene oxide

C3H6O

HCID6479

1,3-Dibromo-5,5-dimethylhydantoin

C5H6Br2N2O2

HCID23931

Mercury

结构：C=C(C)C(C(=O)OCCCC)N1C(=O)C(NC(=O)COc2ccccc2)C1SN1C(=O)c2ccccc2C1=O

HCID21413138

未命名化合物

PRODUCTS

生成物

结构：C=C(CBr)C(C(=O)OCCCC)N1C(=O)C(NC(=O)COc2ccccc2)C1SN1C(=O)c2ccccc2C1=O

HCID21413118

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-48bea53ed2614703a2da95dd319b22b9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[Br:40][N:41]1[C:42]([CH3:43])([CH3:44])[C:45](=[O:46])[N:47]([Br:48])[C:49]1=[O:50].[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][C:6](=[O:7])[CH:8]([C:9](=[CH2:10])[CH3:11])[N:12]1[C:13](=[O:39])[CH:14]([NH:28][C:29]([CH2:30][O:31][c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)=[O:38])[CH:15]1[S:16][N:17]1[C:18](=[O:27])[c:19]2[c:20]([cH:23][cH:24][cH:25][cH:26]2)[C:21]1=[O:22].[CH2:51]1[O:52][CH:53]1[CH3:54].[Cl:56][CH2:57][CH2:58][Cl:59].[Hg:55]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][C:6](=[O:7])[CH:8]([C:9](=[CH2:10])[CH2:11][Br:40])[N:12]1[C:13](=[O:39])[CH:14]([NH:28][C:29]([CH2:30][O:31][c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)=[O:38])[CH:15]1[S:16][N:17]1[C:18](=[O:27])[c:19]2[c:20]([cH:23][cH:24][cH:25][cH:26]2)[C:21]1=[O:22]