HRID825439

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID222

Ammonia gas

H3N

HCID702

Ethanol

C2H6O

HCID11858

Ethyl 2-chloroacetoacetate

C6H9ClO3

HCID14817

Phosphorus pentasulfide

P4S10

HCID75540

2-Methoxybenzamide

C8H9NO2

HCID13576837

Ethyl 2-(2-methoxyphenyl)-4-methyl-1,3-thiazole-5-carboxylate

C14H15NO3S

PRODUCTS

生成物

HCID3068072

5-Thiazolecarboxamide, 2-(2-methoxyphenyl)-4-methyl-

C12H12N2O2S

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-036df9ac83f8432887159a40da30101d
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH3:21][O:22][c:23]1[cH:24][cH:25][cH:26][cH:28][c:29]1[C:30]([NH2:27])=[O:31].[CH3:2][O:3][c:4]1[c:5](-[c:10]2[s:11][c:12]([C:16]([O:18][CH2:17][CH3:19])=[O:20])[c:13]([CH3:15])[n:14]2)[cH:6][cH:7][cH:8][cH:9]1.[CH3:56][CH2:57][OH:58].[Cl:32][CH:33]([C:34]([CH3:35])=[O:36])[C:37]([O:38][CH2:39][CH3:40])=[O:41].[NH3:1].[P:42]12(=[S:55])[S:43][P:44]3(=[S:54])[S:45][P:46](=[S:52])([S:47][P:48](=[S:51])([S:49]3)[S:50]1)[S:53]2>>[CH3:2][O:3][c:4]1[c:5](-[c:10]2[s:11][c:12]([C:16](=[O:18])[NH2:27])[c:13]([CH3:15])[n:14]2)[cH:6][cH:7][cH:8][cH:9]1