Dimethylformamide → (2,4-Dioxo-5-methyl-1-propargyl-3-imidazolidinyl)methyl 2-(2-chloro-4-trifluoromethylphenylamino)-3-methylbutanoate

HRID 1145046Notes

Reaction equation

HRID 1145046 reaction equation
[CH2:57]([Cl:58])[Cl:59].[CH3:33][N:34]([c:35]1[cH:36][cH:37][cH:38][cH:39][n:40]1)[CH3:41].[CH3:60][N:61]([CH3:62])[CH:63]=[O:64].[CH:42]1([N:43]=[C:44]=[N:45][CH:46]2[CH2:47][CH2:48][CH2:49][CH2:50][CH2:51]2)[CH2:52][CH2:53][CH2:54][CH2:55][CH2:56]1.[Cl:14][c:15]1[c:16]([NH:25][CH:26]([CH:27]([CH3:28])[CH3:29])[C:30](=[O:31])[OH:32])[cH:17][cH:18][c:19]([C:21]([F:22])([F:23])[F:24])[cH:20]1.[O:1]=[C:2]1[N:3]([CH2:11][C:12]#[CH:13])[CH:4]([CH3:10])[C:5](=[O:9])[N:6]1[CH2:7][OH:8]>>[O:1]=[C:2]1[N:3]([CH2:11][C:12]#[CH:13])[CH:4]([CH3:10])[C:5](=[O:9])[N:6]1[CH2:7][O:8][C:30]([CH:26]([NH:25][c:16]1[c:15]([Cl:14])[cH:20][c:19]([C:21]([F:22])([F:23])[F:24])[cH:18][cH:17]1)[CH:27]([CH3:28])[CH3:29])=[O:31]

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 6344DichloromethaneHCID 10868DicyclohexylcarbodiimideHCID 218852-DimethylaminopyridineHCID 39476432-{[2-Chloro-4-(trifluoromethyl)phenyl]amino}-3-methylbutanoic acidHCID 20342664(2,4-Dioxo-5-methyl-1-propargyl-3-imidazolidinyl)methanol

Product 1

HCID 20342656(2,4-Dioxo-5-methyl-1-propargyl-3-imidazolidinyl)methyl 2-(2-chloro-4-trifluoromethylphenylamino)-3-methylbutanoate

Sources & evidence

ORD record
ord-2525d0720a1c41f89642544b565d65e6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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