HRID147898

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID3283

Diethyl Ether

C4H10O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID30165

Iodide ion

I-

HCID166653

Hydride

H-

HCID2783006

5-(Chloromethyl)-4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazole

C12H9ClF3NS

HCID69220443

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)COc1ccc(N(CC)Cc2sc(-c3ccc(C(F)(F)F)cc3)nc2C)cc1

HCID69220732

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7442694e5ad345f6ae55aad50a4c7e4e
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

[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][O:6][c:7]1[cH:8][cH:9][c:10]([NH:13][CH2:14][CH3:15])[cH:11][cH:12]1)=[O:16].[CH3:44][CH2:45][O:46][CH2:47][CH3:48].[Cl:17][CH2:18][c:19]1[c:20]([CH3:34])[n:21][c:22](-[c:24]2[cH:25][cH:26][c:27]([C:30]([F:31])([F:32])[F:33])[cH:28][cH:29]2)[s:23]1.[H-:38].[I-:35].[Na+:36].[Na+:37].[O:39]=[CH:40][N:41]([CH3:42])[CH3:43].[OH2:49]>>[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][O:6][c:7]1[cH:8][cH:9][c:10]([N:13]([CH2:14][CH3:15])[CH2:18][c:19]2[c:20]([CH3:34])[n:21][c:22](-[c:24]3[cH:25][cH:26][c:27]([C:30]([F:31])([F:32])[F:33])[cH:28][cH:29]3)[s:23]2)[cH:11][cH:12]1)=[O:16]