HRID1547895

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID151417

Glycine tert-butyl ester

C6H13NO2

结构：O=C(O)CCc1cccc(-c2nc(=O)c3ccccc3s2)n1

HCID9901333

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)CNC(=O)CCc1cccc(-c2nc(=O)c3ccccc3s2)n1

HCID59750322

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-092606aaaa8e480683d55d01b306fb1e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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