2-Chloro-1-(2-methyloxiran-2-ylmethyl)-4-nitroimidazole → 1-(2-Chloro-4-nitroimidazol-1-yl)-2-methyl-3-[4-[4-(trifluoromethyl)anilino]piperazin-1-yl]propan-2-ol

HRID 2314463Notes

Reaction equation

HRID 2314463 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([NH:21][c:22]2[cH:23][cH:24][c:25]([C:28]([F:29])([F:30])[F:31])[cH:26][cH:27]2)[CH2:16][CH2:17][NH:18][CH2:19][CH2:20]1>>[Cl:1][c:2]1[n:3]([CH2:10][C:11]([OH:12])([CH2:13][N:18]2[CH2:17][CH2:16][N:15]([NH:21][c:22]3[cH:23][cH:24][c:25]([C:28]([F:29])([F:30])[F:31])[cH:26][cH:27]3)[CH2:20][CH2:19]2)[CH3:14])[cH:4][c:5]([N+:7](=[O:8])[O-:9])[n:6]1

Participants

3

Reactant 2

HCID 159655232-Chloro-1-(2-methyloxiran-2-ylmethyl)-4-nitroimidazoleHCID 23081312Piperazin-1-yl-(4-trifluoromethylphenyl)amine

Product 1

HCID 230811811-(2-Chloro-4-nitroimidazol-1-yl)-2-methyl-3-[4-[4-(trifluoromethyl)anilino]piperazin-1-yl]propan-2-ol

Sources & evidence

ORD record
ord-ad83e1120b3a405cbd729dad1cce6819
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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