Water → 3-[4-(Trifluoromethyl)phenyl]prop-2-enyl 4-[2-hydroxy-2-methyl-3-[4-nitro-2-(4-nitrophenyl)sulfanylimidazol-1-yl]propyl]piperazine-1-carboxylate

HRID 833432Notes

Reaction equation

HRID 833432 reaction equation
[CH3:1][N:2]([CH3:3])[CH:4]=[O:5].[CH3:52][CH2:53][O:54][C:55](=[O:56])[CH3:57].[CH3:6][C:7]1([CH2:10][n:11]2[c:12]([S:19][c:20]3[cH:21][cH:22][c:23]([N+:26](=[O:27])[O-:28])[cH:24][cH:25]3)[n:13][c:14]([N+:16](=[O:17])[O-:18])[cH:15]2)[O:8][CH2:9]1.[N:29]1([C:35](=[O:36])[O:37][CH2:38][CH:39]=[CH:40][c:41]2[cH:42][cH:43][c:44]([C:47]([F:48])([F:49])[F:50])[cH:45][cH:46]2)[CH2:30][CH2:31][NH:32][CH2:33][CH2:34]1.[OH2:51]>>[CH3:6][C:7]([OH:8])([CH2:9][N:32]1[CH2:31][CH2:30][N:29]([C:35](=[O:36])[O:37][CH2:38][CH:39]=[CH:40][c:41]2[cH:42][cH:43][c:44]([C:47]([F:48])([F:49])[F:50])[cH:45][cH:46]2)[CH2:34][CH2:33]1)[CH2:10][n:11]1[c:12]([S:19][c:20]2[cH:21][cH:22][c:23]([N+:26](=[O:27])[O-:28])[cH:24][cH:25]2)[n:13][c:14]([N+:16](=[O:17])[O-:18])[cH:15]1

Participants

6

Reactant 5

HCID 962WaterHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 665893003-(4-Trifluoromethylphenyl)-2-propenyl piperazine-1-carboxylateHCID 870634031-[(2-Methyloxiran-2-yl)methyl]-4-nitro-2-(4-nitrophenyl)sulfanylimidazole

Product 1

HCID 916005553-[4-(Trifluoromethyl)phenyl]prop-2-enyl 4-[2-hydroxy-2-methyl-3-[4-nitro-2-(4-nitrophenyl)sulfanylimidazol-1-yl]propyl]piperazine-1-carboxylate

Sources & evidence

ORD record
ord-5a52fc882ab0436681babce703832a08
Source dataset
Test data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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