HRID2327708

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8150

Diethylene glycol dimethyl ether

C6H14O3

HCID9240

3-Azabicyclo[3.2.2]nonane

C8H15N

结构：CC(C)(C)C(C)(C)Nc1nc(Cl)nc(NC(C)(C)C(C)(C)C)n1

HCID15572577

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)C(C)(C)Nc1nc(NC(C)(C)C(C)(C)C)nc(N2CC3CCC(CC3)C2)n1

HCID9954415

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9a555669e9ba4d8596219eb2a9fd21ee
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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