HRID818925

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID259

Bromide

Br-

HCID923

Sodium ion

Na+

2 次

HCID16028

Tetrabutylammonium

C16H36N+

HCID19660

Carbonate

CO3-2

结构：CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)c1ncc(Br)cn1

HCID11977091

Di-tert-butyl (5-bromopyrimidin-2-yl)-2-imidodicarbonate

C14H20BrN3O4

HCID21884630

(2-Methylthiophen-3-yl)boronic acid

C5H7BO2S

PRODUCTS

生成物

结构：Cc1sccc1-c1cnc(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)nc1

HCID70081887

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d16940d3914541c5b4db85865505c04c
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[Br-:44].[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]([c:9]1[n:10][cH:11][c:12]([Br:15])[cH:13][n:14]1)[C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22].[CH2:45]([N+:46]([CH2:47][CH2:48][CH2:49][CH3:50])([CH2:51][CH2:52][CH2:53][CH3:54])[CH2:55][CH2:56][CH2:57][CH3:58])[CH2:59][CH2:60][CH3:61].[CH3:23][c:24]1[s:25][cH:26][cH:27][c:28]1[B:29]([OH:30])[OH:31].[Na+:32].[Na+:33].[O-:34][C:35](=[O:36])[O-:37].[cH:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]([c:9]1[n:10][cH:11][c:12](-[c:28]2[c:24]([CH3:23])[s:25][cH:26][cH:27]2)[cH:13][n:14]1)[C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22]