HRID1558544

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID15908

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

C8H17N3

HCID67326

Benzenemethanamine, 4-fluoro-

C7H8FN

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID81531

Diisopropylethylamine

C8H19N

HCID832243

2-Amino-4-methylthiazole-5-carboxylic acid

C5H6N2O2S

PRODUCTS

生成物

HCID55115203

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-82eb89b2a28c4401b6639a13c96dabff
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

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