HRID92917

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID14503249

未命名化合物

结构：Cc1ccccc1-c1ncc(NC(=O)OCc2ccccc2)c(=O)n1CC(=O)O

HCID21851387

未命名化合物

PRODUCTS

生成物

结构：Cc1ccccc1-c1ncc(NC(=O)OCc2ccccc2)c(=O)n1CC(=O)NC(Cc1ccccc1)C(O)C(F)(F)F

HCID21851390

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a9fd46dce49e4296b2fc4d6bf30171d2
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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