HRID665191

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID4187788

(tert-Butyldimethylsilyloxy)acetaldehyde

C8H18O2Si

结构：CC1=C(C#N)C(c2ccc3c(c2)c(N)nn3C(=O)OC(C)(C)C)C(C#N)=C(C)N1

HCID24959832

未命名化合物

PRODUCTS

生成物

结构：CC1=C(C#N)C(c2ccc3c(c2)c(NCCO[Si](C)(C)C(C)(C)C)nn3C(=O)OC(C)(C)C)C(C#N)=C(C)N1

HCID69044121

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9b4cf37f402742f0b48419e8e52f1bf1
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[n:8]1[n:9][c:10]([NH2:29])[c:11]2[cH:12][c:13]([CH:17]3[C:18]([C:27]#[N:28])=[C:19]([CH3:26])[NH:20][C:21]([CH3:25])=[C:22]3[C:23]#[N:24])[cH:14][cH:15][c:16]12.[C:30]([CH3:31])([CH3:32])([CH3:33])[Si:34]([O:35][CH2:36][CH:37]=[O:38])([CH3:39])[CH3:40]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[n:8]1[n:9][c:10]([NH:29][CH2:37][CH2:36][O:35][Si:34]([C:30]([CH3:31])([CH3:32])[CH3:33])([CH3:39])[CH3:40])[c:11]2[cH:12][c:13]([CH:17]3[C:18]([C:27]#[N:28])=[C:19]([CH3:26])[NH:20][C:21]([CH3:25])=[C:22]3[C:23]#[N:24])[cH:14][cH:15][c:16]12