HRID154584

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID8471

Triethylamine

C6H15N

HCID24386

Thionyl Chloride

Cl2OS

HCID121015

Ethyl 3-(N,N-dimethylamino)acrylate

C7H13NO2

HCID68798267

未命名化合物

PRODUCTS

产物

HCID68796206

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-446581d4979f483aa698c846dabc0e35
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应SMILES

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