1-(alpha,alpha,alpha-Trifluoro-m-tolyl)acetone → 2-[1-Methyl-2-(3-trifluoromethyl-phenyl)-ethylamino]-pentanoic acid [1-(1,1-dimethyl-2-pyrrolidin-1-yl-ethyl)-1H-imidazol-4-yl]-amide

HRID 2160828Notes

Reaction equation

HRID 2160828 reaction equation
[CH3:1][C:2]([CH2:3][N:4]1[CH2:5][CH2:6][CH2:7][CH2:8]1)([CH3:9])[n:10]1[cH:11][n:12][c:13]([NH:15][C:16]([CH:17]([CH2:18][CH2:19][CH3:20])[NH2:21])=[O:22])[cH:14]1.[F:23][C:24]([c:25]1[cH:26][c:27]([CH2:31][C:32]([CH3:33])=[O:34])[cH:28][cH:29][cH:30]1)([F:35])[F:36]>>[CH3:1][C:2]([CH2:3][N:4]1[CH2:5][CH2:6][CH2:7][CH2:8]1)([CH3:9])[n:10]1[cH:11][n:12][c:13]([NH:15][C:16]([CH:17]([CH2:18][CH2:19][CH3:20])[NH:21][CH:32]([CH2:31][c:27]2[cH:26][c:25]([C:24]([F:23])([F:35])[F:36])[cH:30][cH:29][cH:28]2)[CH3:33])=[O:22])[cH:14]1

Participants

3

Reactant 2

HCID 891011-(alpha,alpha,alpha-Trifluoro-m-tolyl)acetoneHCID 671642262-Amino-pentanoic acid [1-(1,1-dimethyl-2-pyrrolidin-1-yl-ethyl)-1H-imidazol-4-yl]-amide

Product 1

HCID 116776242-[1-Methyl-2-(3-trifluoromethyl-phenyl)-ethylamino]-pentanoic acid [1-(1,1-dimethyl-2-pyrrolidin-1-yl-ethyl)-1H-imidazol-4-yl]-amide

Sources & evidence

ORD record
ord-4f0d7755a12f42219a5680601a8da877
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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