HRID2314844

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID65578

Ethanedioyl dichloride

C2Cl2O2

结构：Cc1ccn(-c2ccc(C(=O)N3Cc4ccc(C)n4Cc4ccccc43)c(Cl)c2)n1

HCID9802041

未命名化合物

HCID10847454

2-Chloro-4-(3-methyl-1H-pyrazol-1-yl)benzoic acid

C11H9ClN2O2

PRODUCTS

生成物

HCID22605446

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3ec6714689fa4979a56cec701475e09b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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