HRID1223139

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID21942978

未命名化合物

HCID68630407

未命名化合物

PRODUCTS

生成物

结构：CC(NC(=O)Cc1cc(F)cc(F)c1)C(=O)NC1C(=O)N(CC2CC2)c2ccccc2OC1c1ccccc1

HCID178465054

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b9b3085a2aa444eb8e3fdf8adc702082
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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