HRID147103

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID6344

Dichloromethane

CH2Cl2

HCID6916

Diethylcarbamoyl chloride

C5H10ClNO

结构：CCOC(=O)c1ccc2c(c1)CC(C)(C)C(c1cccc(N)c1)N2

HCID67442796

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)c1ccc2c(c1)CC(C)(C)C(c1cccc(NC(=O)N(CC)CC)c1)N2

HCID67440483

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-93604a3600b1486396358b5313155a14
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[cH:7][c:8]2[c:13]([cH:14][cH:15]1)[NH:12][CH:11]([c:16]1[cH:17][c:18]([NH2:22])[cH:19][cH:20][cH:21]1)[C:10]([CH3:23])([CH3:24])[CH2:9]2.[CH2:31]([CH3:32])[N:33]([C:34](=[O:35])[Cl:36])[CH2:37][CH3:38].[Cl:39][CH2:40][Cl:41].[cH:25]1[cH:26][cH:27][n:28][cH:29][cH:30]1>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[cH:7][c:8]2[c:13]([cH:14][cH:15]1)[NH:12][CH:11]([c:16]1[cH:17][c:18]([NH:22][C:34]([N:33]([CH2:31][CH3:32])[CH2:37][CH3:38])=[O:35])[cH:19][cH:20][cH:21]1)[C:10]([CH3:23])([CH3:24])[CH2:9]2