HRID1149478

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID6422

Trifluoroacetic acid

C2HF3O2

HCID10348309

t-butylcarbamate

C5H11NO2

2 次

HCID71208332

3-aminomethyl-7-chloro-2-oxazol-2-yl-1-phenyl-1H-quinolin-4-one

C19H14ClN3O2

PRODUCTS

产物

HCID6422

Trifluoroacetic acid

C2HF3O2

HCID71208332

3-aminomethyl-7-chloro-2-oxazol-2-yl-1-phenyl-1H-quinolin-4-one

C19H14ClN3O2

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-201c9229fdec4e2194564f70e9d88595
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应SMILES

[C:1]([NH:2][C:3](=[O:4])[OH:5])([CH3:6])([CH3:7])[CH3:8].[C:9]([NH:10][C:11](=[O:12])[OH:13])([CH3:14])([CH3:15])[CH3:16].[Cl:49][CH2:50][Cl:51].[NH2:17][CH2:18][c:19]1[c:20](-[c:37]2[o:38][cH:39][cH:40][n:41]2)[n:21](-[c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[c:22]2[cH:23][c:24]([Cl:30])[cH:25][cH:26][c:27]2[c:28]1=[O:29].[OH:42][C:43](=[O:44])[C:45]([F:46])([F:47])[F:48]>>[NH2:17][CH2:18][c:19]1[c:20](-[c:37]2[o:38][cH:39][cH:40][n:41]2)[n:21](-[c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[c:22]2[cH:23][c:24]([Cl:30])[cH:25][cH:26][c:27]2[c:28]1=[O:29].[O:42]=[C:43]([OH:44])[C:45]([F:46])([F:47])[F:48]