Chloride → HCID 20289291, compound

HRID 1141328Notes

Reaction equation

HRID 1141328 reaction equation
[Cl-:1].[Cl:2][c:3]1[c:4]([NH:13][CH:14]([C:15](=[O:16])[OH:17])[CH:18]([CH3:19])[CH3:20])[cH:5][cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1.[F:21][c:22]1[cH:23][cH:24][c:25]([CH2:26][c:27]2[c:28]([CH2:32][OH:33])[nH:29][cH:30][cH:31]2)[cH:34][cH:35]1>>[Cl:2][c:3]1[c:4]([NH:13][CH:14]([C:15](=[O:16])[O:17][CH2:32][c:28]2[c:27]([CH2:26][c:25]3[cH:24][cH:23][c:22]([F:21])[cH:35][cH:34]3)[cH:31][cH:30][nH:29]2)[CH:18]([CH3:19])[CH3:20])[cH:5][cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1

Participants

4

Reactant 3

HCID 312ChlorideHCID 39476432-{[2-Chloro-4-(trifluoromethyl)phenyl]amino}-3-methylbutanoic acidHCID 544646223-(4-Fluorobenzyl)-pyrrolylmethyl alcohol

Product 1

HCID 20289291HCID 20289291, compound

Sources & evidence

ORD record
ord-996c3773249c4e869af43ab65bb5d763
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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