HRID1118464

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID13387

N-Methyl-2-pyrrolidone

C5H9NO

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID123458

1-Methoxy-2-propylamine

C4H11NO

结构：CCn1nnnc1-c1cc(C(=O)O)cc(-c2ccc(C)cc2)c1

HCID57851262

未命名化合物

PRODUCTS

生成物

结构：CCn1nnnc1-c1cc(C(=O)NC(C)COC)cc(-c2ccc(C)cc2)c1

HCID57850957

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bcb82afad79d4495b3ef8c0f650a9017
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

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