HRID1557968

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

HCID813

Potassium cation

K+

HCID961

Hydroxide

HO-

HCID8028

Tetrahydrofuran

C4H8O

HCID83681

Tris(1,1-dimethylethyl)phosphine

C12H27P

HCID59479612

未命名化合物

HCID59479616

N-[(6-Bromo-2-pyridinyl)methylene]-2,6-bis(1-methylethyl)benzenamine

C18H21BrN2

HCID178527693

未命名化合物

PRODUCTS

生成物

结构：C=CCCOc1cc(-c2cccc(C=Nc3c(C(C)C)cccc3C(C)C)n2)c(C)cc1C

HCID59479617

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3006a97d16dd4a9395d945b946718e87
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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