Ethanol → 3-(2-Pyridyl)-5-(3-amino-5-cyanophenyl)-1,2,4-oxadiazole

Reaction equation

[CH3:31][CH2:32][OH:33].[Cl:28][CH2:29][Cl:30].[OH2:23].[OH2:24].[Sn:25]([Cl:26])[Cl:27].[n:1]1[c:2](-[c:7]2[n:8][o:9][c:10](-[c:12]3[cH:13][c:14]([C:21]#[N:22])[cH:15][c:16]([N+:18]([O-:19])=[O:20])[cH:17]3)[n:11]2)[cH:3][cH:4][cH:5][cH:6]1>>[n:1]1[c:2](-[c:7]2[n:8][o:9][c:10](-[c:12]3[cH:13][c:14]([C:21]#[N:22])[cH:15][c:16]([NH2:18])[cH:17]3)[n:11]2)[cH:3][cH:4][cH:5][cH:6]1

Participants

Reactant 5

HCID 702Ethanol

HCID 962Water2×

HCID 6344Dichloromethane

HCID 24479Stannous Chloride

HCID 219425113-(2-Pyridyl)-5-(3-cyano-5-nitrophenyl)-1,2,4-oxadiazole

Product 1

HCID 219426193-(2-Pyridyl)-5-(3-amino-5-cyanophenyl)-1,2,4-oxadiazole

Sources & evidence

ORD record: ord-310abf9c937a463381f7c5933e3d59d8
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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