HRID1574796

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID11776

Triphenylphosphine

C18H15P

HCID19660

Carbonate

CO3-2

HCID104967

Cesium(1+)

Cs+

2 次

HCID105144

Palladium(2+)

Pd+2

HCID66869043

未命名化合物

HCID86063644

未命名化合物

PRODUCTS

生成物

结构：CC(C)Cn1c(N)nc2ccc(-c3oc(C(C)(C)C)nc3-c3ccc(F)cc3)nc21

HCID68870828

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9e5e7d7ede88459180dc397c1c9a62a6
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:17][c:18]1[cH:19][cH:20][c:21]2[c:22]([n:23]1)[n:24]([CH2:28][CH:29]([CH3:30])[CH3:31])[c:25]([NH2:27])[n:26]2.[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[o:6][cH:7][c:8](-[c:10]2[cH:11][cH:12][c:13]([F:16])[cH:14][cH:15]2)[n:9]1.[C:32](=[O:33])([O-:34])[O-:35].[Cs+:36].[Cs+:37].[O-:63][C:64]([CH3:65])=[O:66].[O-:67][C:68]([CH3:69])=[O:70].[O:57]=[CH:58][N:59]([CH3:60])[CH3:61].[Pd+2:62].[c:38]1([P:39]([c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)[cH:52][cH:53][cH:54][cH:55][cH:56]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[o:6][c:7](-[c:18]2[cH:19][cH:20][c:21]3[c:22]([n:23]2)[n:24]([CH2:28][CH:29]([CH3:30])[CH3:31])[c:25]([NH2:27])[n:26]3)[c:8](-[c:10]2[cH:11][cH:12][c:13]([F:16])[cH:14][cH:15]2)[n:9]1