HRID1233445

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID15908

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

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID2737531

4-Amino-1-methylpiperidine

C6H14N2

HCID178524954

未命名化合物

PRODUCTS

生成物

结构：CN1CCC(NC(=O)c2n[nH]cc2NC(=O)c2c(F)cccc2F)CC1

HCID178480472

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-52050be8df9e4470b0a107702404698a
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

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