HRID120043

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID9340

Norchlorcyclizine

C17H19ClN2

HCID19660

Carbonate

CO3-2

HCID2305635

2-chloro-N-(2,4,6-trimethylphenyl)acetamide

C11H14ClNO

PRODUCTS

生成物

结构：Cc1cc(C)c(NC(=O)CN2CCN(C(c3ccccc3)c3ccc(Cl)cc3)CC2)c(C)c1

HCID15143638

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4c754b68eaa347c3a98de7ed98b18c52
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](=[O:2])([O-:3])[O-:4].[CH3:27][c:28]1[c:29]([NH:36][C:37]([CH2:38][Cl:39])=[O:40])[c:30]([CH3:35])[cH:31][c:32]([CH3:34])[cH:33]1.[CH3:41][CH2:42][O:43][C:44](=[O:45])[CH3:46].[CH3:47][N:48]([CH3:49])[CH:50]=[O:51].[Cl:7][c:8]1[cH:9][cH:10][c:11]([CH:12]([c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[N:19]2[CH2:20][CH2:21][NH:22][CH2:23][CH2:24]2)[cH:25][cH:26]1.[K+:5].[K+:6]>>[Cl:7][c:8]1[cH:9][cH:10][c:11]([CH:12]([c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[N:19]2[CH2:20][CH2:21][N:22]([CH2:38][C:37]([NH:36][c:29]3[c:28]([CH3:27])[cH:33][c:32]([CH3:34])[cH:31][c:30]3[CH3:35])=[O:40])[CH2:23][CH2:24]2)[cH:25][cH:26]1