HRID826914

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID19660

Carbonate Ion

CO3-2

HCID2734389

4-(Trifluoromethyl)phenylboronic acid

C7H6BF3O2

HCID66752927

未命名化合物

HCID66753471

6-(3,5-Difluorophenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one

C13H8F2N2OS

PRODUCTS

产物

HCID66752802

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-ee169734517b4be8b417e28024038329
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应SMILES

[CH3:1][c:2]1[n:3][c:4]2[n:5]([c:6](=[O:16])[c:7]1-[c:8]1[cH:9][cH:10][c:11]([C:12]#[N:13])[cH:14][cH:15]1)[cH:17][cH:18][s:19]2.[CH3:58][c:59]1[cH:60][cH:61][cH:62][cH:63][cH:64]1.[CH3:66][CH2:67][OH:68].[F:20][C:21]([c:22]1[cH:23][cH:24][c:25]([B:28]([OH:29])[OH:30])[cH:26][cH:27]1)([F:31])[F:32].[F:39][c:40]1[cH:41][c:42](-[c:43]2[c:44](=[O:45])[n:46]3[cH:47][cH:48][s:49][c:50]3[n:51][c:52]2[CH3:53])[cH:54][c:55]([F:56])[cH:57]1.[Na+:33].[Na+:34].[O-:35][C:36](=[O:37])[O-:38].[OH2:65]>>[CH3:1][c:2]1[n:3][c:4]2[n:5]([c:6](=[O:16])[c:7]1-[c:25]1[cH:24][cH:23][c:22]([C:21]([F:20])([F:31])[F:32])[cH:27][cH:26]1)[cH:17][cH:18][s:19]2