HRID207836

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID1355

1-(3-Chlorophenyl)piperazine

C10H13ClN2

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID256581

3-Bromo-N-(triphenylmethyl)propan-1-amine

C22H22BrN

PRODUCTS

生成物

结构：Clc1cccc(N2CCN(CCCNC(c3ccccc3)(c3ccccc3)c3ccccc3)CC2)c1

HCID19810680

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-910e9d6197f140ce9e43676d4e457240
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

[Br:14][CH2:15][CH2:16][CH2:17][NH:18][C:19]([c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1)([c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1)[c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[C:38](=[O:39])([O-:40])[O-:41].[CH3:44][N:45]([CH3:46])[CH:47]=[O:48].[Cl:1][c:2]1[cH:3][cH:4][cH:5][c:6]([N:8]2[CH2:9][CH2:10][NH:11][CH2:12][CH2:13]2)[cH:7]1.[K+:42].[K+:43].[OH2:49]>>[Cl:1][c:2]1[cH:3][cH:4][cH:5][c:6]([N:8]2[CH2:9][CH2:10][N:11]([CH2:15][CH2:16][CH2:17][NH:18][C:19]([c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)([c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[c:32]3[cH:33][cH:34][cH:35][cH:36][cH:37]3)[CH2:12][CH2:13]2)[cH:7]1