HRID134255

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID11466409

1-[(5-Chloro-pyridin-2-ylcarbamoyl)-methyl]-2-(1-isopropyl-piperidin-4-ylcarbamoyl)-1H-benzoimidazole-4-carboxylic acid methyl ester

C25H29ClN6O4

PRODUCTS

产物

HCID11375453

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-f83ffa8614184192bc87d2ec1cb1928a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应SMILES

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