Hydrochloric Acid → 2-[3-(2,5-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]sulfanylpropane-1,3-diol

HRID 146246Notes

Reaction equation

HRID 146246 reaction equation
[ClH:32].[F:1][c:2]1[c:3]([C:9]([CH2:10][n:11]2[n:12][cH:13][n:14][cH:15]2)([CH:16]([CH3:17])[S:18][CH:19]2[CH2:20][O:21][CH:22]([c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)[O:23][CH2:24]2)[OH:31])[cH:4][c:5]([F:8])[cH:6][cH:7]1>>[F:1][c:2]1[c:3]([C:9]([CH2:10][n:11]2[n:12][cH:13][n:14][cH:15]2)([CH:16]([CH3:17])[S:18][CH:19]([CH2:20][OH:21])[CH2:24][OH:23])[OH:31])[cH:4][c:5]([F:8])[cH:6][cH:7]1

Participants

3

Reactant 2

HCID 313Hydrochloric AcidHCID 1784773112-(2,5-difluorophenyl)-3-[(2-phenyl-1,3-dioxan-5-yl)sulfanyl]-1-(1,2,4-triazol-1-yl)butan-2-ol

Product 1

HCID 1784774512-[3-(2,5-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]sulfanylpropane-1,3-diol

Sources & evidence

ORD record
ord-eb4aee3934414107b885ee7b04d5f906
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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