HRID126462

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID679

Dimethyl sulfoxide

C2H6OS

HCID813

Potassium cation

K+

2 次

HCID19660

Carbonate

CO3-2

HCID21979554

4,6-Dichloro-5-(4-methylphenyl)pyrimidine

C11H8Cl2N2

HCID22461010

未命名化合物

PRODUCTS

生成物

结构：CC(=O)OCC(C)(C)c1ccc(S(=O)(=O)Nc2ncnc(Cl)c2-c2ccc(C)cc2)cc1

HCID22461011

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-de1efd2efc414663ad738c93aeae7275
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[C:16]([CH3:17])(=[O:18])[O:19][CH2:20][C:21]([CH3:22])([CH3:23])[c:24]1[cH:25][cH:26][c:27]([S:30](=[O:31])(=[O:32])[NH2:33])[cH:28][cH:29]1.[C:34](=[O:35])([O-:36])[O-:37].[CH3:41][S:42]([CH3:43])=[O:44].[Cl:1][c:2]1[n:3][cH:4][n:5][c:6]([Cl:15])[c:7]1-[c:8]1[cH:9][cH:10][c:11]([CH3:14])[cH:12][cH:13]1.[ClH:40].[K+:38].[K+:39]>>[c:2]1([NH:33][S:30]([c:27]2[cH:26][cH:25][c:24]([C:21]([CH2:20][O:19][C:16]([CH3:17])=[O:18])([CH3:22])[CH3:23])[cH:29][cH:28]2)(=[O:31])=[O:32])[n:3][cH:4][n:5][c:6]([Cl:15])[c:7]1-[c:8]1[cH:9][cH:10][c:11]([CH3:14])[cH:12][cH:13]1