HRID1215991

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID263

1-Butanol

C4H10O

HCID81531

Diisopropylethylamine

C8H19N

HCID5287830

Purine, 6-bromo-

C5H3BrN4

HCID57707783

未命名化合物

PRODUCTS

生成物

结构：Clc1ccccc1-c1nc2c(Cl)cccc2nc1CNc1ncnc2[nH]cnc12

HCID178478023

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0de74157ce7a439f974e248498a9a6af
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

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