HRID152638

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID6228

Dimethylformamide

C3H7NO

HCID19660

Carbonate Ion

CO3-2

HCID104967

Cesium(1+)

Cs+

2 次

HCID54032292

4-Dimethoxymethyl-2-fluoro-1-nitrobenzene

C9H10FNO4

HCID59375361

2-Amino-4-(4-trifluoromethyl-phenyl)-thiazole-5-carboxylic acid amide

C11H8F3N3OS

PRODUCTS

产物

HCID86642849

2-(5-Dimethoxymethyl-2-nitro-phenylamino)-4-(4-trifluoromethyl-phenyl)-thiazole-5-carboxylic acid amide

C20H17F3N4O5S

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-a84c379dce4f4198948e0e575a4507b5
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

[C:35](=[O:36])([O-:37])[O-:38].[CH3:20][O:21][CH:22]([c:23]1[cH:24][c:25]([F:32])[c:26]([N+:29](=[O:30])[O-:31])[cH:27][cH:28]1)[O:33][CH3:34].[CH3:43][N:44]([CH3:45])[CH:46]=[O:47].[Cl-:41].[Cs+:39].[Cs+:40].[NH2:1][c:2]1[s:3][c:4]([C:17](=[O:18])[NH2:19])[c:5](-[c:7]2[cH:8][cH:9][c:10]([C:13]([F:14])([F:15])[F:16])[cH:11][cH:12]2)[n:6]1.[NH4+:42]>>[NH:1]([c:2]1[s:3][c:4]([C:17](=[O:18])[NH2:19])[c:5](-[c:7]2[cH:8][cH:9][c:10]([C:13]([F:14])([F:15])[F:16])[cH:11][cH:12]2)[n:6]1)[c:25]1[cH:24][c:23]([CH:22]([O:21][CH3:20])[O:33][CH3:34])[cH:28][cH:27][c:26]1[N+:29](=[O:30])[O-:31]