HRID136223

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID2760632

o-tolyl-acetyl chloride

C9H9ClO

HCID18917501

未命名化合物

PRODUCTS

生成物

结构：Cc1ccccc1CC(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cn1

HCID18917528

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a071a42d420e44cdab3cf5ab3e0c23ef
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

[CH3:24][c:25]1[c:26]([CH2:31][C:32](=[O:33])[Cl:34])[cH:27][cH:28][cH:29][cH:30]1.[CH3:35][CH2:36][N:37]([CH2:38][CH3:39])[CH2:40][CH3:41].[Cl:42][CH2:43][Cl:44].[NH2:1][c:2]1[cH:3][cH:4][c:5]([C:8](=[O:9])[N:10]2[CH2:11][c:12]3[n:13]([cH:21][cH:22][cH:23]3)[CH2:14][c:15]3[c:16]2[cH:17][cH:18][cH:19][cH:20]3)[cH:6][n:7]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([C:8](=[O:9])[N:10]2[CH2:11][c:12]3[n:13]([cH:21][cH:22][cH:23]3)[CH2:14][c:15]3[c:16]2[cH:17][cH:18][cH:19][cH:20]3)[cH:6][n:7]1)[C:32]([CH2:31][c:26]1[c:25]([CH3:24])[cH:30][cH:29][cH:28][cH:27]1)=[O:33]