HRID942324

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID6344

Dichloromethane

CH2Cl2

HCID19660

Carbonate

CO3-2

HCID31275

1,4-Dioxane

C4H8O2

HCID2773987

1-Methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole

C10H17BN2O2

结构：O=C(Nc1cn2nc(C(F)(F)c3nnc4ccc(Br)cn34)ccc2n1)C1CC1

HCID59233213

未命名化合物

PRODUCTS

生成物

结构：Cn1cc(-c2ccc3nnc(C(F)(F)c4ccc5nc(NC(=O)C6CC6)cn5n4)n3c2)cn1

HCID56593558

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-89896bf1491446b8b1d46bbde26a329f
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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