HRID97853

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID176

Acetic Acid

C2H4O2

HCID813

Potassium cation

K+

2 次

HCID923

Sodium ion

Na+

HCID19660

Carbonate

CO3-2

HCID1268291

4-Amino-1-Boc-piperidine

C10H20N2O2

HCID2724942

未命名化合物

HCID13206432

2,5-Dimethyl-1H-imidazole-4-carbaldehyde

C6H8N2O

PRODUCTS

生成物

结构：Cc1nc(CNC2CCN(C(=O)OC(C)(C)C)CC2)c(C)[nH]1

HCID23138170

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-59a1b87b41e04d6d8a23a795ed843370
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:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([NH2:14])[CH2:12][CH2:13]1.[C:24]([O:25][BH-:26]([O:27][C:28](=[O:29])[CH3:30])[O:31][C:32](=[O:33])[CH3:34])(=[O:35])[CH3:36].[C:38](=[O:39])([O-:40])[O-:41].[CH3:15][c:16]1[nH:17][c:18]([CH3:23])[c:19]([CH:21]=[O:22])[n:20]1.[CH3:48][C:49](=[O:50])[OH:51].[Cl:44][CH2:45][CH2:46][Cl:47].[K+:42].[K+:43].[Na+:37]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([NH:14][CH2:21][c:19]2[c:18]([CH3:23])[nH:17][c:16]([CH3:15])[n:20]2)[CH2:12][CH2:13]1