HRID813191

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6342

Acetonitrile

C2H3N

HCID19660

Carbonate

CO3-2

HCID104967

Cesium(1+)

Cs+

2 次

反应SMILES：FC(F)(F)c1cccc(-c2nc(CCl)no2)c1

HCID2736622

3-(Chloromethyl)-5-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole

C10H6ClF3N2O

反应SMILES：N#Cc1ccc2[nH]c(CCC(F)(F)F)cc2c1C(F)(F)F

HCID57800210

未命名化合物

PRODUCTS

产物

反应SMILES：N#Cc1ccc2c(cc(CCC(F)(F)F)n2Cc2noc(-c3cccc(C(F)(F)F)c3)n2)c1C(F)(F)F

HCID57800518

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-b8245ca029c84e7b863618c1a8099fb4
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

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