HRID824610

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID244

Benzyl alcohol

C7H8O

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

结构：CC(=O)SCC(Cc1ccccc1)C(=O)Nc1cccc(C(=O)O)c1

HCID10215552

Benzoic acid, 3-[[2-[(acetylthio)methyl]-1-oxo-3-phenylpropyl]amino]-

C19H19NO4S

PRODUCTS

生成物

结构：CC(=O)SCC(Cc1ccccc1)C(=O)Nc1cccc(C(=O)OCc2ccccc2)c1

HCID15670217

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a8954f04312d418088f3663bf60e515b
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:1]([CH3:2])(=[O:3])[S:4][CH2:5][CH:6]([C:7](=[O:8])[NH:9][c:10]1[cH:11][c:12]([C:13](=[O:14])[OH:15])[cH:16][cH:17][cH:18]1)[CH2:19][c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1.[CH2:34]([Cl:35])[CH2:36][Cl:37].[CH3:39][N:40]([CH3:41])[c:42]1[cH:43][cH:44][n:45][cH:46][cH:47]1.[Cl:48][CH2:49][Cl:50].[ClH:38].[OH:26][CH2:27][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1>>[C:1]([CH3:2])(=[O:3])[S:4][CH2:5][CH:6]([C:7](=[O:8])[NH:9][c:10]1[cH:11][c:12]([C:13](=[O:14])[O:15][CH2:27][c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[cH:16][cH:17][cH:18]1)[CH2:19][c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1