HRID1200992

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8071

未命名化合物

HCID75676

Diethyl (cyanomethyl)phosphonate

C6H12NO3P

HCID166653

Hydride

H-

结构：O=Cc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)c(F)n1

HCID53779028

未命名化合物

PRODUCTS

生成物

结构：N#CC=Cc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)c(F)n1

HCID53719604

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fff744f29ebc45fdaf18ef996aff0d8e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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