HRID1233187

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID16658

N-Aminopiperidine

C5H12N2

HCID65578

Ethanedioyl dichloride

C2Cl2O2

结构：Cc1c(C(=O)O)nc(-c2ccc(Cl)cc2Cl)n1-c1ccc(OCc2ccccc2)cc1

HCID59465506

2-(2,4-Dichlorophenyl)-5-methyl-1-[4-(phenylmethoxy)phenyl]-1H-imidazole-4-carboxylic acid

C24H18Cl2N2O3

PRODUCTS

生成物

结构：Cc1c(C(=O)NN2CCCCC2)nc(-c2ccc(Cl)cc2Cl)n1-c1ccc(OCc2ccccc2)cc1

HCID11489517

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-db22ed7ac2ed485d8a170aee6df4e892
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12](-[n:15]2[c:16](-[c:24]3[c:25]([Cl:31])[cH:26][c:27]([Cl:30])[cH:28][cH:29]3)[n:17][c:18]([C:21](=[O:22])[OH:23])[c:19]2[CH3:20])[cH:13][cH:14]1.[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[Cl:32][C:33]([C:34]([Cl:35])=[O:36])=[O:37].[Cl:52][CH2:53][Cl:54].[NH2:45][N:46]1[CH2:47][CH2:48][CH2:49][CH2:50][CH2:51]1.[O:56]=[CH:57][N:58]([CH3:59])[CH3:60].[OH2:55]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12](-[n:15]2[c:16](-[c:24]3[c:25]([Cl:31])[cH:26][c:27]([Cl:30])[cH:28][cH:29]3)[n:17][c:18]([C:21](=[O:22])[NH:45][N:46]3[CH2:47][CH2:48][CH2:49][CH2:50][CH2:51]3)[c:19]2[CH3:20])[cH:13][cH:14]1