HRID1223584

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID813

Potassium cation

K+

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID7504

Benzylamine

C7H9N

HCID105144

Palladium(2+)

Pd+2

HCID2734215

2-(Di-tert-butylphosphino)biphenyl

C20H27P

HCID4574913

未命名化合物

结构：CC(C)[Si](C(C)C)(C(C)C)n1cc(Cc2ccc(Cl)nc2)c2cccnc21

HCID57588077

未命名化合物

PRODUCTS

生成物

结构：CC(C)[Si](C(C)C)(C(C)C)n1cc(Cc2ccc(NCc3ccccc3)nc2)c2cccnc21

HCID57588064

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-034cb9558c0942968015eb8c07e488bf
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

[C:42]([P:43]([C:44]([CH3:45])([CH3:46])[CH3:47])[c:48]1[cH:49][cH:50][cH:51][cH:52][c:53]1-[c:54]1[cH:55][cH:56][cH:57][cH:58][cH:59]1)([CH3:60])([CH3:61])[CH3:62].[C:63]([O-:64])(=[O:65])[CH3:66].[C:68]([O-:69])(=[O:70])[CH3:71].[CH3:36][C:37]([CH3:38])([O-:39])[CH3:40].[CH3:73][c:74]1[cH:75][cH:76][cH:77][cH:78][cH:79]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][c:9]2[cH:10][n:11]([Si:18]([CH:19]([CH3:20])[CH3:21])([CH:22]([CH3:23])[CH3:24])[CH:25]([CH3:26])[CH3:27])[c:12]3[n:13][cH:14][cH:15][cH:16][c:17]23)[cH:6][n:7]1.[K+:41].[NH2:28][CH2:29][c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1.[OH2:72].[Pd+2:67]>>[c:2]1([NH:28][CH2:29][c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[cH:3][cH:4][c:5]([CH2:8][c:9]2[cH:10][n:11]([Si:18]([CH:19]([CH3:20])[CH3:21])([CH:22]([CH3:23])[CH3:24])[CH:25]([CH3:26])[CH3:27])[c:12]3[n:13][cH:14][cH:15][cH:16][c:17]23)[cH:6][n:7]1