HRID2159979

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8857

Ethyl acetate

C4H8O2

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID10330133

未命名化合物

HCID16773111

[(4-Bromophenyl)methyl]hydrazine

C7H9BrN2

PRODUCTS

生成物

结构：COC(=O)NC(C(=O)NNCc1ccc(Br)cc1)C(C)(C)C

HCID178502240

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f60da19fb500438cb4ebf75b1f49b885
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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