HRID94004

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8083

Morpholine

C4H9NO

HCID81531

Diisopropylethylamine

C8H19N

HCID204484

Propylphosphonic acid

C3H9O3P

结构：O=C(O)c1nccnc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1

HCID57942381

未命名化合物

PRODUCTS

生成物

结构：O=C(c1nccnc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)N1CCOCC1

HCID11539686

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ef943c508ebc494f8348fe38f6e3c6ac
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

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