HRID149221

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3776

Isopropanol

C3H8O

HCID77575

2,2-Diphenylethylamine

C14H15N

HCID81531

Diisopropylethylamine

C8H19N

HCID270265

2,6-dichloro-9-(tetrahydro-2h-pyran-2-yl)-9h-purine

C10H10Cl2N4O

PRODUCTS

生成物

结构：Clc1nc(NCC(c2ccccc2)c2ccccc2)c2ncn(C3CCCCO3)c2n1

HCID10181335

2-Chloro-N-(2,2-diphenylethyl)-9-tetrahydro-2H-pyran-2-yl-9H-purin-6-amine

C24H24ClN5O

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-29db1a4f1786403e880fbaaf2a35696d
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

[CH2:18]([N:19]([CH:20]([CH3:21])[CH3:22])[CH:23]([CH3:24])[CH3:25])[CH3:26].[CH:42]([OH:43])([CH3:44])[CH3:45].[Cl:1][c:2]1[n:3][c:4]([Cl:17])[c:5]2[n:6][cH:7][n:8]([CH:11]3[O:12][CH2:13][CH2:14][CH2:15][CH2:16]3)[c:9]2[n:10]1.[c:27]1([CH:33]([CH2:34][NH2:35])[c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[cH:28][cH:29][cH:30][cH:31][cH:32]1>>[Cl:1][c:2]1[n:3][c:4]([NH:35][CH2:34][CH:33]([c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[c:5]2[n:6][cH:7][n:8]([CH:11]3[O:12][CH2:13][CH2:14][CH2:15][CH2:16]3)[c:9]2[n:10]1