HRID310223

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID40494

4-(Oxiran-2-yl)benzonitrile

C9H7NO

HCID166653

Hydride

H-

结构：OCc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cn1

HCID382182

1-Trityl-1H-imidazole-4-methanol

C23H20N2O

PRODUCTS

生成物

结构：N#Cc1ccc(C(O)COCc2cn(C(c3ccccc3)(c3ccccc3)c3ccccc3)cn2)cc1

HCID66782189

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-12c930e89a0e48eb8a44d9b77f8223ec
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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