Sodium Ion → 2-methyl-6-nitro-2-[(4-phenylpiperidin-1-yl)methyl]-3H-imidazo[2,1-b][1,3]oxazole

Reaction equation

[Cl:1][c:2]1[n:3]([CH2:10][C:11]([CH2:12][N:13]2[CH2:14][CH2:15][CH:16]([c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[CH2:17][CH2:18]2)([OH:25])[CH3:26])[cH:4][c:5]([N+:7](=[O:8])[O-:9])[n:6]1.[H-:27].[Na+:28].[O:30]=[CH:31][N:32]([CH3:33])[CH3:34].[OH2:29]>>[c:2]12[n:3]([cH:4][c:5]([N+:7](=[O:8])[O-:9])[n:6]1)[CH2:10][C:11]([CH2:12][N:13]1[CH2:14][CH2:15][CH:16]([c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[CH2:17][CH2:18]1)([CH3:26])[O:25]2

Participants

Reactant 5

HCID 923Sodium Ion

HCID 962Water

HCID 6228Dimethylformamide

HCID 166653Hydride

HCID 230812331-(2-Chloro-4-nitroimidazol-1-yl)-2-methyl-3-(4-phenylpiperidin-1-yl)propan-2-ol

Product 1

HCID 230815892-methyl-6-nitro-2-[(4-phenylpiperidin-1-yl)methyl]-3H-imidazo[2,1-b][1,3]oxazole

Sources & evidence

ORD record: ord-6db8fc4697834ee38f12632399f24b07
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

Reaction notes

Loading…