Ammonium → tert-butyl N-[4-[4-(triazol-1-yl)butyl]phenyl]-N-[[2-[2-[4-(trifluoromethylsulfinyl)phenyl]ethenyl]-1,3-oxazol-4-yl]methyl]carbamate

HRID 945036Notes

Reaction equation

HRID 945036 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[cH:9][cH:10][c:11]([CH2:14][CH2:15][CH2:16][CH2:17][n:18]2[n:19][n:20][cH:21][cH:22]2)[cH:12][cH:13]1)=[O:23].[CH3:49][N:50]([CH3:51])[CH:52]=[O:53].[Cl-:47].[Cl:26][CH2:27][c:28]1[n:29][c:30]([CH:33]=[CH:34][c:35]2[cH:36][cH:37][c:38]([S:41](=[O:42])[C:43]([F:44])([F:45])[F:46])[cH:39][cH:40]2)[o:31][cH:32]1.[H-:24].[NH4+:48].[Na+:25]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([N:7]([c:8]1[cH:9][cH:10][c:11]([CH2:14][CH2:15][CH2:16][CH2:17][n:18]2[n:19][n:20][cH:21][cH:22]2)[cH:12][cH:13]1)[CH2:27][c:28]1[n:29][c:30]([CH:33]=[CH:34][c:35]2[cH:36][cH:37][c:38]([S:41](=[O:42])[C:43]([F:44])([F:45])[F:46])[cH:39][cH:40]2)[o:31][cH:32]1)=[O:23]

Participants

8

Reactant 7

HCID 223AmmoniumHCID 312ChlorideHCID 923Sodium ionHCID 6228DimethylformamideHCID 166653HydrideHCID 69220256[4-(4-[1,2,3]Triazol-1-yl-butyl)phenyl]-carbamic acid tert-butyl esterHCID 692923894-Chloromethyl-2-[2-(4-trifluoromethylsulfinyl-phenyl)-vinyl]-oxazole

Product 1

HCID 77660560tert-butyl N-[4-[4-(triazol-1-yl)butyl]phenyl]-N-[[2-[2-[4-(trifluoromethylsulfinyl)phenyl]ethenyl]-1,3-oxazol-4-yl]methyl]carbamate

Sources & evidence

ORD record
ord-b4479cb9520c4c0a9c8fd8e2d31def22
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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