HRID1143453

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

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID333435

未命名化合物

HCID521961

未命名化合物

PRODUCTS

生成物

结构：CCCCC(NC(=O)OC(C)(C)C)C(=O)NCc1ccccc1

HCID18932987

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7fb950397019472d8ddda47492c61dee
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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