HRID1131523

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID679

Dimethyl sulfoxide

C2H6OS

HCID813

Potassium cation

K+

2 次

HCID11776

Triphenylphosphine

C18H15P

2 次

HCID19660

Carbonate

CO3-2

HCID24290

未命名化合物

HCID66827

Boronic acid, phenyl-

C6H7BO2

HCID519380

2-Amino-3-bromo-5-methylpyridine

C6H7BrN2

HCID9834204

未命名化合物

PRODUCTS

生成物

HCID22263547

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-67254276e592402eb9deffd6d3789dbc
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][NH:2][C:3](=[O:4])[CH2:5][CH2:6][C:7]([NH2:8])=[O:9].[C:28](=[O:29])([O-:30])[O-:31].[CH3:34][C:35](=[O:36])[OH:37].[CH3:38][S:39]([CH3:40])=[O:41].[K+:32].[K+:33].[NH2:10][c:11]1[n:12][cH:13][c:14]([CH3:18])[cH:15][c:16]1[Br:17].[OH:19][B:20]([OH:21])[c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1.[Pd:42]([Cl:43])[Cl:44].[c:45]1([P:46]([c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)[c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)[cH:59][cH:60][cH:61][cH:62][cH:63]1.[c:64]1([P:65]([c:66]2[cH:67][cH:68][cH:69][cH:70][cH:71]2)[c:72]2[cH:73][cH:74][cH:75][cH:76][cH:77]2)[cH:78][cH:79][cH:80][cH:81][cH:82]1>>[NH2:10][c:11]1[n:12][cH:13][c:14]([CH3:18])[cH:15][c:16]1-[c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1