HRID1117898

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

HCID702

Ethanol

C2H6O

HCID813

Potassium cation

K+

HCID923

Sodium ion

Na+

2 次

HCID6344

Dichloromethane

CH2Cl2

HCID19660

Carbonate

CO3-2

HCID31275

1,4-Dioxane

C4H8O2

HCID25215940

6-Bromo[1,2,4]triazolo[1,5-a]pyridin-2-amine

C6H5BrN4

HCID61794951

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)NS(=O)(=O)c1cncc(-c2ccc3nc(N)nn3c2)c1

HCID42623223

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d0021013be1048d78439ea9a28745de5
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[Br:1][c:2]1[cH:3][c:4]([S:8](=[O:9])(=[O:10])[NH:11][C:12]([CH3:13])([CH3:14])[CH3:15])[cH:5][n:6][cH:7]1.[Br:21][c:22]1[cH:23][cH:24][c:25]2[n:26]([cH:27]1)[n:28][c:29]([NH2:31])[n:30]2.[C:32](=[O:33])([O-:34])[O-:35].[CH3:17][C:18](=[O:19])[O-:20].[CH3:41][CH2:42][OH:43].[Cl:38][CH2:39][Cl:40].[K+:16].[Na+:36].[Na+:37].[O:44]1[CH2:45][CH2:46][O:47][CH2:48][CH2:49]1>>[c:2]1(-[c:22]2[cH:23][cH:24][c:25]3[n:26]([cH:27]2)[n:28][c:29]([NH2:31])[n:30]3)[cH:3][c:4]([S:8](=[O:9])(=[O:10])[NH:11][C:12]([CH3:13])([CH3:14])[CH3:15])[cH:5][n:6][cH:7]1