HRID169064

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID1135

Thymine

C5H6N2O2

HCID1140

Toluene

C7H8

HCID6212

Chloroform

CHCl3

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

结构：CC(C)(C)OC(=O)CN(CCOS(C)(=O)=O)Cc1ccccc1

HCID15817340

未命名化合物

PRODUCTS

生成物

结构：Cc1cn(CCN(CC(=O)OC(C)(C)C)Cc2ccccc2)c(=O)[nH]c1=O

HCID15817341

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-34f406813b9c457e9929ac9a77f650c1
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:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][N:8]([CH2:9][CH2:10][O:11][S:12]([CH3:13])(=[O:14])=[O:15])[CH2:16][c:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1)=[O:23].[C:33](=[O:34])([O-:35])[O-:36].[CH3:39][c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1.[CH3:46][N:47]([CH3:48])[CH:49]=[O:50].[CH:51]([Cl:52])([Cl:53])[Cl:54].[K+:37].[K+:38].[nH:24]1[c:25](=[O:26])[nH:27][c:28](=[O:29])[c:30]([CH3:31])[cH:32]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][N:8]([CH2:9][CH2:10][n:24]1[c:25](=[O:26])[nH:27][c:28](=[O:29])[c:30]([CH3:31])[cH:32]1)[CH2:16][c:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1)=[O:23]