HRID671150

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6212

Chloroform

CHCl3

HCID8857

Ethyl acetate

C4H8O2

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID2760937

未命名化合物

HCID57458238

1-(2-Chlorophenyl)-3-(trifluoromethyl)-1H-pyrazole-5-carbonyl chloride

C11H5Cl2F3N2O

PRODUCTS

生成物

结构：CS(=O)(=O)c1cccc(CNC(=O)c2cc(C(F)(F)F)nn2-c2ccccc2Cl)c1

HCID59240355

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fc1c3819bc1442cc9fa6cca2a47a9ecf
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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