HRID2325637

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3301

Ethylenediamine

C2H8N2

HCID6228

Dimethylformamide

C3H7NO

HCID8028

Tetrahydrofuran

C4H8O

HCID24386

Thionyl chloride

Cl2OS

反应SMILES：CS(=O)(=O)OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1

HCID18387265

[3,5-Bis(trifluoromethyl)phenyl]methyl methanesulfonate

C10H8F6O3S

HCID18387312

未命名化合物

PRODUCTS

产物

反应SMILES：NCCNCc1cc(C(F)(F)F)cc(C(F)(F)F)c1

HCID18387337

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-265f40a9283b4adaa6604c5397210c02
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应SMILES

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