HRID162475

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID813

Potassium cation

K+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID12433

Dibromoacetic acid

C2H2Br2O2

HCID19660

Carbonate

CO3-2

结构：Cc1cc(O)c(O)cc1S(=O)(=O)c1ccc2nc(C(C)(C)C)sc2c1

HCID23312088

未命名化合物

PRODUCTS

生成物

结构：Cc1cc2c(cc1S(=O)(=O)c1ccc3nc(C(C)(C)C)sc3c1)OC(C(=O)O)O2

HCID23312041

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b9693fc5fd1746308d0b15b071e792f5
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

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