HRID670027

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID166653

Hydride

H-

结构：CC1(C)NC(=O)N(c2ccc(OC(F)(F)F)cc2)C1=O

HCID13268067

5,5-Dimethyl-3-[4-(trifluoromethoxy)phenyl]imidazolidine-2,4-dione

C12H11F3N2O3

HCID17900617

未命名化合物

PRODUCTS

生成物

结构：COc1ccc2nccc(CN3C(=O)N(c4ccc(OC(F)(F)F)cc4)C(=O)C3(C)C)c2c1

HCID59694268

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c129c545160a48f6b8a9a4c312e9c7d9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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