HRID193163

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID326496

1-(2-chloroethyl)-3-ethyl-2-imidazolidinone

C7H13ClN2O

HCID3019427

4-Amino-5-chloro-2-methoxy-N-(3-methoxypiperidin-4-yl)benzamide

C14H20ClN3O3

PRODUCTS

生成物

结构：CCN1CCN(CCN2CCC(NC(=O)c3cc(Cl)c(N)cc3OC)C(OC)C2)C1=O

HCID57264064

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-559b43844be84af48c104c33cb864990
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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