HRID817156

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID16028

Tetrabutylammonium

C16H36N+

HCID30165

Iodide ion

I-

HCID166653

Hydride

H-

HCID24229503

5-[2-(Bromomethyl)phenyl]-3-methyl-1,2,4-oxadiazole

C10H9BrN2O

HCID67251745

未命名化合物

PRODUCTS

生成物

结构：Cc1noc(-c2ccccc2CN2CCCC3(CCN(c4cnc5ccccc5n4)CC3)C2=O)n1

HCID53259467

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-47d2874e822f472a8b4451cc3f497a8e
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:25][CH2:26][c:27]1[c:28](-[c:33]2[n:34][c:35]([CH3:38])[n:36][o:37]2)[cH:29][cH:30][cH:31][cH:32]1.[CH2:41]([N+:42]([CH2:43][CH2:44][CH2:45][CH3:46])([CH2:47][CH2:48][CH2:49][CH3:50])[CH2:51][CH2:52][CH2:53][CH3:54])[CH2:55][CH2:56][CH3:57].[CH2:58]1[O:59][CH2:60][CH2:61][CH2:62]1.[CH3:63][CH2:64][O:65][C:66](=[O:67])[CH3:68].[H-:23].[I-:40].[Na+:24].[OH2:39].[n:1]1[c:2]([N:11]2[CH2:12][CH2:13][C:14]3([CH2:15][CH2:16][CH2:17][NH:18][C:19]3=[O:20])[CH2:21][CH2:22]2)[cH:3][n:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12>>[n:1]1[c:2]([N:11]2[CH2:12][CH2:13][C:14]3([CH2:15][CH2:16][CH2:17][N:18]([CH2:26][c:27]4[c:28](-[c:33]5[n:34][c:35]([CH3:38])[n:36][o:37]5)[cH:29][cH:30][cH:31][cH:32]4)[C:19]3=[O:20])[CH2:21][CH2:22]2)[cH:3][n:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12