HRID689279

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

HCID11557851

3-amino-N-(5-chloropyridin-2-yl)pyridine-2-carboxamide

C11H9ClN4O

HCID178475392

未命名化合物

PRODUCTS

生成物

结构：CC(=O)Oc1cc(C)ccc1C(=S)Nc1cccnc1C(=O)Nc1ccc(Cl)cn1

HCID86620002

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-259940700a3644c6b520c955b518286a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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