HRID679398

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID23151038

未命名化合物

HCID45119260

未命名化合物

PRODUCTS

生成物

结构：CC(=O)Nc1nccc(CSc2ncccc2C(=O)Nc2cc(C)cc(C)c2)n1

HCID11964855

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4c3617933ebe40819ce825c3023be552
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:26]([CH3:27])(=[O:28])[NH:29][c:30]1[n:31][cH:32][cH:33][c:34]([CH2:36][Cl:37])[n:35]1.[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[CH3:38][CH2:39][O:40][C:41](=[O:42])[CH3:43].[CH3:44][N:45]([CH3:46])[CH:47]=[O:48].[CH3:8][c:9]1[cH:10][c:11]([NH:16][C:17](=[O:18])[c:19]2[c:20](=[S:25])[nH:21][cH:22][cH:23][cH:24]2)[cH:12][c:13]([CH3:15])[cH:14]1>>[CH3:8][c:9]1[cH:10][c:11]([NH:16][C:17](=[O:18])[c:19]2[c:20]([S:25][CH2:36][c:34]3[cH:33][cH:32][n:31][c:30]([NH:29][C:26]([CH3:27])=[O:28])[n:35]3)[n:21][cH:22][cH:23][cH:24]2)[cH:12][c:13]([CH3:15])[cH:14]1