HRID202462

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3847030

4,4-Difluorocyclohexanamine

C6H11F2N

结构：Cc1nc2ccccc2n1-c1nc(N2CCOCC2)c2nc(CBr)n(C)c2n1

HCID59605812

4-(8-(bromomethyl)-9-methyl-2-(2-methyl-1H-benzo[d]imidazol-1-yl)-9H-purin-6-yl)morpholine

C19H20BrN7O

PRODUCTS

生成物

结构：Cc1nc2ccccc2n1-c1nc(N2CCOCC2)c2nc(CNC3CCC(F)(F)CC3)n(C)c2n1

HCID59605382

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8becc02b262242bbb18088b8b2c1e846
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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