HRID161997

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID2760632

o-tolyl-acetyl chloride

C9H9ClO

HCID10828280

未命名化合物

PRODUCTS

生成物

结构：Cc1ccccc1CC(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1

HCID21837119

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bace535940114e57bdd7822f9ad3f672
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

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