HRID136888

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID59166722

未命名化合物

结构：CC1(C)C(=O)CC(c2cc(F)cc(F)c2)N(CC(=O)O)C1=O

HCID178428999

未命名化合物

PRODUCTS

生成物

结构：CC1(C)C(=O)CC(c2cc(F)cc(F)c2)N(CC(=O)Nc2ccc3c(c2)CC2(C3)C(=O)Nc3ncccc32)C1=O

HCID57977528

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6d068e707b7f41b58f486dfe3db7e37e
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

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