HRID175029

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID1049

Pyridine

C5H5N

HCID6344

Dichloromethane

CH2Cl2

HCID6916

Diethylcarbamoyl chloride

C5H10ClNO

HCID8471

Triethylamine

C6H15N

HCID19900408

未命名化合物

PRODUCTS

生成物

结构：CCN(CC)C(=O)OC1c2ccccc2C(=O)N1c1ccc2ccc(Cl)nc2n1

HCID22754741

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f3ac755c018e4da0b0c9b4fc31d6db1d
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

[CH2:23]([CH3:24])[N:25]([C:26](=[O:27])[Cl:28])[CH2:29][CH3:30].[CH2:44]([Cl:45])[Cl:46].[CH3:31][CH2:32][N:33]([CH2:34][CH3:35])[CH2:36][CH3:37].[Cl:1][c:2]1[cH:3][cH:4][c:5]2[cH:6][cH:7][c:8]([N:12]3[C:13](=[O:22])[c:14]4[cH:15][cH:16][cH:17][cH:18][c:19]4[CH:20]3[OH:21])[n:9][c:10]2[n:11]1.[OH2:47].[cH:38]1[cH:39][cH:40][n:41][cH:42][cH:43]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[cH:6][cH:7][c:8]([N:12]3[C:13](=[O:22])[c:14]4[cH:15][cH:16][cH:17][cH:18][c:19]4[CH:20]3[O:21][C:26]([N:25]([CH2:23][CH3:24])[CH2:29][CH3:30])=[O:27])[n:9][c:10]2[n:11]1