HRID297801

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID15908

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

C8H17N3

HCID68804332

未命名化合物

HCID77556456

未命名化合物

PRODUCTS

生成物

结构：CC(NC(=O)COc1cc(F)c(C(C)(C)C)c(F)c1)c1ccc(NS(C)(=O)=O)c(CO)c1

HCID11854282

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-333424cdb27c45d497fee4b2f2738fe2
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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