HRID154342

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID702

Ethanol

C2H6O

结构：CCCn1c(=O)c2c(nc(-c3cnn(CC4CC4c4cccc(C(F)(F)F)c4)c3)n2COCC[Si](C)(C)C)n(CCC)c1=O

HCID57988779

未命名化合物

PRODUCTS

生成物

结构：CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC4c4cccc(C(F)(F)F)c4)c3)nc2n(CCC)c1=O

HCID57988765

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-25e403c9cc854dbbbef3f78963d27a13
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

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