HRID1140931

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID1140

Toluene

C7H8

HCID4837

Piperazine

C4H10N2

HCID2734215

2-(Di-tert-butylphosphino)biphenyl

C20H27P

HCID4574913

未命名化合物

HCID57832783

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)c1ccc(-c2cn3cccc(N4CCNCC4)c3n2)cc1

HCID57832789

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a41009d2a41249aa8bf62030e32d6aec
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[Br:1][c:2]1[c:3]2[n:4]([cH:5][cH:6][cH:7]1)[cH:8][c:9](-[c:11]1[cH:12][cH:13][c:14]([C:17]([CH3:18])([CH3:19])[CH3:20])[cH:15][cH:16]1)[n:10]2.[C:21]([P:22]([C:23]([CH3:24])([CH3:25])[CH3:26])[c:27]1[cH:28][cH:29][cH:30][cH:31][c:32]1-[c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1)([CH3:39])([CH3:40])[CH3:41].[CH2:48]1[CH2:49][NH:50][CH2:51][CH2:52][NH:53]1.[CH3:42][C:43]([CH3:44])([O-:45])[CH3:46].[CH3:54][c:55]1[cH:56][cH:57][cH:58][cH:59][cH:60]1.[Na+:47]>>[c:2]1([N:50]2[CH2:49][CH2:48][NH:53][CH2:52][CH2:51]2)[c:3]2[n:4]([cH:5][cH:6][cH:7]1)[cH:8][c:9](-[c:11]1[cH:12][cH:13][c:14]([C:17]([CH3:18])([CH3:19])[CH3:20])[cH:15][cH:16]1)[n:10]2