HRID137159

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID8028

Tetrahydrofuran

C4H8O

HCID76467

Benzonitrile, 4-iodo-

C7H4IN

结构：O=Cc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cn1

HCID618233

1-Tritylimidazole-4-carboxaldehyde

C23H18N2O

HCID178461726

未命名化合物

PRODUCTS

生成物

结构：N#Cc1ccc(C(O)c2cn(C(c3ccccc3)(c3ccccc3)c3ccccc3)cn2)cc1

HCID15435710

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-aecef1049391441db44533b1c1007ce2
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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