HRID947107

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID813

Potassium cation

K+

2 次

HCID887

Methanol

CH4O

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

结构：CC(=O)Nc1cccc(-n2c(=O)n(C3CC3)c(=O)c3c(Nc4ccc(C#C[Si](C)(C)C)cc4F)n(C)c(=O)c(C)c32)c1

HCID59717184

未命名化合物

PRODUCTS

生成物

结构：C#Cc1ccc(Nc2c3c(=O)n(C4CC4)c(=O)n(-c4cccc(NC(C)=O)c4)c3c(C)c(=O)n2C)c(F)c1

HCID59717172

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7ddb4ab5878447f882df876cee05f095
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:43](=[O:44])([O-:45])[O-:46].[CH3:49][N:50]([CH3:51])[CH:52]=[O:53].[CH3:54][OH:55].[CH:1]1([n:4]2[c:5](=[O:42])[n:6](-[c:32]3[cH:33][c:34]([NH:38][C:39]([CH3:40])=[O:41])[cH:35][cH:36][cH:37]3)[c:7]3[c:8]([c:9]2=[O:10])[c:11]([NH:18][c:19]2[c:20]([F:31])[cH:21][c:22]([C:25]#[C:26][Si:27]([CH3:28])([CH3:29])[CH3:30])[cH:23][cH:24]2)[n:12]([CH3:17])[c:13](=[O:16])[c:14]3[CH3:15])[CH2:2][CH2:3]1.[ClH:56].[K+:47].[K+:48].[OH2:57]>>[CH:1]1([n:4]2[c:5](=[O:42])[n:6](-[c:32]3[cH:33][c:34]([NH:38][C:39]([CH3:40])=[O:41])[cH:35][cH:36][cH:37]3)[c:7]3[c:8]([c:9]2=[O:10])[c:11]([NH:18][c:19]2[c:20]([F:31])[cH:21][c:22]([C:25]#[CH:26])[cH:23][cH:24]2)[n:12]([CH3:17])[c:13](=[O:16])[c:14]3[CH3:15])[CH2:2][CH2:3]1