HRID178148

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID9991796

未命名化合物

HCID43147881

Methyl β-amino-2-naphthalenepropanoate

C14H15NO2

PRODUCTS

生成物

结构：COC(=O)CC(NC(=O)C(CSC(C)=O)Cc1ccccc1)c1ccc2ccccc2c1

HCID86746977

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5ca0ea90ec8e46669a97e0d176706696
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[C:19]([CH3:20])(=[O:21])[S:22][CH2:23][CH:24]([C:25](=[O:26])[OH:27])[CH2:28][c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1.[CH2:35]([Cl:36])[CH2:37][Cl:38].[CH3:1][O:2][C:3]([CH2:4][CH:5]([NH2:6])[c:7]1[cH:8][c:9]2[cH:10][cH:11][cH:12][cH:13][c:14]2[cH:15][cH:16]1)=[O:17].[CH3:54][CH2:55][N:56]([CH2:57][CH3:58])[CH2:59][CH3:60].[ClH:18].[O:49]=[CH:50][N:51]([CH3:52])[CH3:53].[OH:39][n:40]1[c:41]2[c:42]([cH:43][cH:44][cH:45][cH:46]2)[n:47][n:48]1>>[CH3:1][O:2][C:3]([CH2:4][CH:5]([NH:6][C:25]([CH:24]([CH2:23][S:22][C:19]([CH3:20])=[O:21])[CH2:28][c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1)=[O:26])[c:7]1[cH:8][c:9]2[cH:10][cH:11][cH:12][cH:13][c:14]2[cH:15][cH:16]1)=[O:17]