HRID821175

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID5943

Carbon tetrachloride

CCl4

HCID97895

1-Ethoxyethyl acetate

C6H12O3

结构：C=C(C)C(C(=O)OCc1ccccc1)N1C(=O)C(NC(=O)COc2ccccc2)C1SS(=O)(=O)c1ccccc1

HCID13170072

未命名化合物

PRODUCTS

生成物

结构：C=C(CCl)C(C(=O)OCc1ccccc1)N1C(=O)C(NC(=O)COc2ccccc2)C1SS(=O)(=O)c1ccccc1

HCID13170074

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-88b66c4266ed4d888efba4258e449255
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:47]([Cl:48])([Cl:49])([Cl:50])[Cl:51].[C:52]([O:53][CH:54]([O:55][CH2:56][CH3:57])[CH3:58])(=[O:59])[CH3:60].[Na+:45].[O-:41][C:42]([OH:43])=[O:44].[O:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH2:8][C:9](=[O:10])[NH:11][CH:12]1[C:13](=[O:40])[N:14]([CH:26]([C:27](=[O:28])[O:29][CH2:30][c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[C:37](=[CH2:38])[CH3:39])[CH:15]1[S:16][S:17](=[O:18])(=[O:19])[c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1.[OH2:46]>>[O:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH2:8][C:9](=[O:10])[NH:11][CH:12]1[C:13](=[O:40])[N:14]([CH:26]([C:27](=[O:28])[O:29][CH2:30][c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[C:37](=[CH2:38])[CH2:39][Cl:48])[CH:15]1[S:16][S:17](=[O:18])(=[O:19])[c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1