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

HRID 2158755Notes

Reaction equation

HRID 2158755 reaction equation
[Cl:1][c:2]1[c:3]([N:9]2[CH2:10][CH2:11][N:12]([C:15](=[O:16])[O:17][C:18]([CH3:19])([CH3:20])[CH3:21])[CH2:13][CH2:14]2)[cH:4][cH:5][c:6]([OH:8])[cH:7]1.[Cl:24][c:25]1[n:26]([CH2:33][C:34]2([CH3:37])[O:35][CH2:36]2)[cH:27][c:28]([N+:30](=[O:31])[O-:32])[n:29]1.[H-:22].[Na+:23].[O:38]=[CH:39][N:40]([CH3:41])[CH3:42]>>[Cl:1][c:2]1[c:3]([N:9]2[CH2:10][CH2:11][N:12]([C:15](=[O:16])[O:17][C:18]([CH3:19])([CH3:20])[CH3:21])[CH2:13][CH2:14]2)[cH:4][cH:5][c:6]([O:8][CH2:36][C:34]2([CH3:37])[CH2:33][n:26]3[c:25]([n:29][c:28]([N+:30](=[O:31])[O-:32])[cH:27]3)[O:35]2)[cH:7]1

Participants

6

Reactant 5

HCID 923Sodium ionHCID 6228DimethylformamideHCID 166653HydrideHCID 159655232-Chloro-1-(2-methyloxiran-2-ylmethyl)-4-nitroimidazoleHCID 23081264Tert-butyl 4-(2-chloro-4-hydroxyphenyl)-piperazine-1-carboxylate

Product 1

HCID 77713015tert-butyl 4-[2-chloro-4-[(2-methyl-6-nitro-3H-imidazo[2,1-b][1,3]oxazol-2-yl)methoxy]phenyl]piperazine-1-carboxylate

Sources & evidence

ORD record
ord-b1160ef6a2f54223ae218b6f06d1c2b3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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