Sodium ion → [4-(trifluoromethoxy)phenyl]methyl 4-[(2-methyl-6-nitro-3H-imidazo[2,1-b][1,3]oxazol-2-yl)methyl]piperazine-1-carboxylate

HRID 86026Notes

Reaction equation

HRID 86026 reaction equation
[CH3:38][CH2:39][O:40][C:41](=[O:42])[CH3:43].[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][CH2:22][c:23]3[cH:24][cH:25][c:26]([O:29][C:30]([F:31])([F:32])[F:33])[cH:27][cH:28]3)[CH2:17][CH2:18]2)([CH3:34])[OH:35])[cH:4][c:5]([N+:7](=[O:8])[O-:9])[n:6]1.[H-:36].[Na+:37].[O:45]=[CH:46][N:47]([CH3:48])[CH3:49].[OH2:44]>>[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][CH2:22][c:23]3[cH:24][cH:25][c:26]([O:29][C:30]([F:31])([F:32])[F:33])[cH:27][cH:28]3)[CH2:17][CH2:18]1)([CH3:34])[O:35]2

Participants

7

Reactant 6

HCID 923Sodium ionHCID 962WaterHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 166653HydrideHCID 77712956HCID 77712956, compound

Product 1

HCID 77713067[4-(trifluoromethoxy)phenyl]methyl 4-[(2-methyl-6-nitro-3H-imidazo[2,1-b][1,3]oxazol-2-yl)methyl]piperazine-1-carboxylate

Sources & evidence

ORD record
ord-d3bcd664580347449f53d3c33830908c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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