HRID1149210

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

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

HCID67072134

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)COc1ccc(N(C)Cc2sc(-c3ccc(C(F)(F)F)cc3)nc2C)cc1CCCOC

HCID69220724

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9138958078de43c0b0aba5b2ce5ea90a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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