HRID934041

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID6344

Dichloromethane

CH2Cl2

HCID8071

未命名化合物

HCID19660

Carbonate

CO3-2

结构：CC(C)(C)OC(=O)N1CCN(c2ccc(B3OC(C)(C)C(C)(C)O3)cc2)CC1

HCID2795514

tert-Butyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]piperazine-1-carboxylate

C21H33BN2O4

HCID42281383

7-Bromopyrrolo[2,1-f][1,2,4]triazin-4-amine

C6H5BrN4

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCN(c2ccc(-c3ccc4c(N)ncnn34)cc2)CC1

HCID58529456

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b2cd92b7f8e941259f2f245d6e910c33
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[c:6]([NH2:11])[n:7][cH:8][n:9][n:10]12.[C:43](=[O:44])([O-:45])[O-:46].[CH3:12][C:13]1([CH3:14])[C:15]([CH3:16])([CH3:17])[O:18][B:19]([c:20]2[cH:21][cH:22][c:23]([N:26]3[CH2:27][CH2:28][N:29]([C:32](=[O:33])[O:34][C:35]([CH3:36])([CH3:37])[CH3:38])[CH2:30][CH2:31]3)[cH:24][cH:25]2)[O:39]1.[CH3:49][O:50][CH2:51][CH2:52][O:53][CH3:54].[Cl:40][CH2:41][Cl:42].[Na+:47].[Na+:48]>>[c:2]1(-[c:20]2[cH:21][cH:22][c:23]([N:26]3[CH2:27][CH2:28][N:29]([C:32](=[O:33])[O:34][C:35]([CH3:36])([CH3:37])[CH3:38])[CH2:30][CH2:31]3)[cH:24][cH:25]2)[cH:3][cH:4][c:5]2[c:6]([NH2:11])[n:7][cH:8][n:9][n:10]12