HRID146221

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

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID11983854

3-amino-N-cyclopropyl-4-methylbenzamide

C11H14N2O

HCID65501190

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(C(=O)NC2CC2)cc1NC(=O)c1ccc(=O)n(-c2c(Cl)cccc2Cl)c1

HCID59234669

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d04e3d148a8b446e9f9d26124ee1f4ac
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

[CH3:43][CH2:44][N:45]([CH2:46][CH3:47])[CH2:48][CH3:49].[CH3:55][CH2:56][O:57][C:58]([CH3:59])=[O:60].[Cl:1][c:2]1[c:3](-[n:9]2[cH:10][c:11]([C:16](=[O:17])[OH:18])[cH:12][cH:13][c:14]2=[O:15])[c:4]([Cl:8])[cH:5][cH:6][cH:7]1.[NH2:19][c:20]1[cH:21][c:22]([C:23](=[O:24])[NH:25][CH:26]2[CH2:27][CH2:28]2)[cH:29][cH:30][c:31]1[CH3:32].[O:50]=[CH:51][N:52]([CH3:53])[CH3:54].[OH:33][n:34]1[c:35]2[c:36]([cH:37][cH:38][cH:39][cH:40]2)[n:41][n:42]1>>[Cl:1][c:2]1[c:3](-[n:9]2[cH:10][c:11]([C:16](=[O:18])[NH:19][c:20]3[cH:21][c:22]([C:23](=[O:24])[NH:25][CH:26]4[CH2:27][CH2:28]4)[cH:29][cH:30][c:31]3[CH3:32])[cH:12][cH:13][c:14]2=[O:15])[c:4]([Cl:8])[cH:5][cH:6][cH:7]1