Dimethylformamide → 1-(2-Chloro-4-nitroimidazol-1-yl)-2-methyl-3-[4-[[4-(trifluoromethyl)phenyl]methylideneamino]piperazin-1-yl]propan-2-ol

HRID 153511Notes

Reaction equation

HRID 153511 reaction equation
[Cl:1][c:2]1[n:3]([CH2:10][C:11]2([CH3:14])[O:12][CH2:13]2)[cH:4][c:5]([N+:7](=[O:8])[O-:9])[n:6]1.[N:15]1([N:21]=[CH:22][c:23]2[cH:24][cH:25][c:26]([C:29]([F:30])([F:31])[F:32])[cH:27][cH:28]2)[CH2:16][CH2:17][NH:18][CH2:19][CH2:20]1.[O:33]=[CH:34][N:35]([CH3:36])[CH3:37]>>[Cl:1][c:2]1[n:3]([CH2:10][C:11]([OH:12])([CH2:13][N:18]2[CH2:17][CH2:16][N:15]([N:21]=[CH:22][c:23]3[cH:24][cH:25][c:26]([C:29]([F:30])([F:31])[F:32])[cH:27][cH:28]3)[CH2:20][CH2:19]2)[CH3:14])[cH:4][c:5]([N+:7](=[O:8])[O-:9])[n:6]1

Participants

4

Reactant 3

HCID 6228DimethylformamideHCID 159655232-Chloro-1-(2-methyloxiran-2-ylmethyl)-4-nitroimidazoleHCID 69481693Piperazin-1-yl-(4-trifluoromethylbenzylidene)-amine

Product 1

HCID 694815711-(2-Chloro-4-nitroimidazol-1-yl)-2-methyl-3-[4-[[4-(trifluoromethyl)phenyl]methylideneamino]piperazin-1-yl]propan-2-ol

Sources & evidence

ORD record
ord-a79ee7ccec0245b8b8c6efd6d6f7613e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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