HRID107300

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID8028

Tetrahydrofuran

C4H8O

HCID81531

Diisopropylethylamine

C8H19N

HCID2782774

2,4-Dichloro-5-(trifluoromethyl)pyrimidine

C5HCl2F3N2

HCID57037824

未命名化合物

结构：CS(=O)(=O)c1cccc(CNc2nc(Cl)ncc2C(F)(F)F)c1

HCID86653999

未命名化合物

PRODUCTS

生成物

结构：CS(=O)c1cccc(CNc2nc(Cl)ncc2C(F)(F)F)c1

HCID86654001

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-10cc2bb8d60a42b288d8f03619b6e78e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH2:57]1[O:58][CH2:59][CH2:60][CH2:61]1.[CH3:37][S:38]([c:39]1[cH:40][c:41]([CH2:42][NH2:43])[cH:44][cH:45][cH:46]1)=[O:47].[CH:48]([N:49]([CH:50]([CH3:51])[CH3:52])[CH2:53][CH3:54])([CH3:55])[CH3:56].[Cl:1][c:2]1[n:3][cH:4][c:5]([C:20]([F:21])([F:22])[F:23])[c:6]([NH:8][CH2:9][c:10]2[cH:11][c:12]([S:16](=[O:17])(=[O:18])[CH3:19])[cH:13][cH:14][cH:15]2)[n:7]1.[Cl:24][c:25]1[n:26][c:27]([Cl:28])[c:29]([C:30]([F:31])([F:32])[F:33])[cH:34][n:35]1.[ClH:36]>>[Cl:1][c:2]1[n:3][cH:4][c:5]([C:20]([F:21])([F:22])[F:23])[c:6]([NH:8][CH2:9][c:10]2[cH:11][c:12]([S:16](=[O:17])[CH3:19])[cH:13][cH:14][cH:15]2)[n:7]1