Sodium ion → 2-(4-Tert-butoxycarbonylpiperazin-1-yl)methyl-2-methyl-6-nitro-2,3-dihydroimidazo[2,1-b]oxazole

HRID 200920Notes

Reaction equation

HRID 200920 reaction equation
[CH3:30][CH2:31][O:32][C:33](=[O:34])[CH3:35].[Cl:1][c:2]1[n:3]([CH2:10][C:11]([CH2:12][N:13]2[CH2:14][CH2:15][N:16]([C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[CH2:17][CH2:18]2)([CH3:26])[OH:27])[cH:4][c:5]([N+:7](=[O:8])[O-:9])[n:6]1.[H-:28].[Na+:29].[O:37]=[CH:38][N:39]([CH3:40])[CH3:41].[OH2:36]>>[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][N:16]([C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[CH2:17][CH2:18]1)([CH3:26])[O:27]2

Participants

7

Reactant 6

HCID 923Sodium ionHCID 962WaterHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 166653HydrideHCID 69481160Tert-butyl 4-[3-(2-chloro-4-nitroimidazol-1-yl)-2-hydroxy-2-methylpropyl]piperazine-1-carboxylate

Product 1

HCID 230810802-(4-Tert-butoxycarbonylpiperazin-1-yl)methyl-2-methyl-6-nitro-2,3-dihydroimidazo[2,1-b]oxazole

Sources & evidence

ORD record
ord-ee168606680b4580871f3d30daa3f11e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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