HRID300826

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID7909

4-Methyl-2-pentanone

C6H12O

HCID19660

Carbonate

CO3-2

HCID70048

Norcyclizine

C17H20N2

HCID3653471

1-(2-Chloroethyl)-1,3-dihydro-2H-benzimidazol-2-one

C9H9ClN2O

PRODUCTS

生成物

结构：O=c1[nH]c2ccccc2n1CCN1CCN(C(c2ccccc2)c2ccccc2)CC1

HCID13105525

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-977f31e18c43485a953ed1d799a11c02
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[CH3:39][CH:40]([CH3:41])[CH2:42][C:43](=[O:44])[CH3:45].[Cl:1][CH2:2][CH2:3][n:4]1[c:5](=[O:13])[nH:6][c:7]2[c:8]1[cH:9][cH:10][cH:11][cH:12]2.[Na+:33].[Na+:34].[O-:35][C:36](=[O:37])[O-:38].[OH2:46].[c:14]1([CH:20]([N:21]2[CH2:22][CH2:23][NH:24][CH2:25][CH2:26]2)[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[cH:15][cH:16][cH:17][cH:18][cH:19]1>>[CH2:2]([CH2:3][n:4]1[c:5](=[O:13])[nH:6][c:7]2[c:8]1[cH:9][cH:10][cH:11][cH:12]2)[N:24]1[CH2:23][CH2:22][N:21]([CH:20]([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[CH2:26][CH2:25]1