Acetic Acid → HCID 178433274, compound

HRID 2341197Notes

Reaction equation

HRID 2341197 reaction equation
[CH3:28][c:29]1[n:30][cH:31][nH:32][c:33]1[CH:34]=[O:35].[CH3:36][C:37](=[O:38])[OH:39].[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]([CH2:9][c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)([NH2:16])[c:17]2[cH:18][c:19]([F:27])[cH:20][c:21]([C:23]([F:24])([F:25])[F:26])[cH:22]2)[n:6][cH:7]1.[Cl:40][CH:41]([Cl:42])[CH3:43]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]([CH2:9][c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)([NH:16][CH2:34][c:33]2[c:29]([CH3:28])[n:30][cH:31][nH:32]2)[c:17]2[cH:18][c:19]([F:27])[cH:20][c:21]([C:23]([F:24])([F:25])[F:26])[cH:22]2)[n:6][cH:7]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 63651,1-DichloroethaneHCID 27958875-Methyl-1H-imidazole-4-carbaldehydeHCID 591345731-(5-Chloropyridin-2-yl)-1-(3-fluoro-5-(trifluoromethyl)phenyl)-2-phenylethanamine

Product 1

HCID 178433274HCID 178433274, compound

Sources & evidence

ORD record
ord-fc7fd08f72924978b24b32bebf34c243
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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