Hydrochloric Acid → [5-Methylsulfonyl-2-(1,1,1-trifluoropropan-2-yloxy)phenyl]-[4-[4-methyl-5-(trifluoromethyl)-1,3-thiazol-2-yl]piperazin-1-yl]methanone

HRID 1552809Notes

Reaction equation

HRID 1552809 reaction equation
[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8]([O:14][CH:15]([C:16]([F:17])([F:18])[F:19])[CH3:20])[c:9]([C:10](=[O:11])[OH:12])[cH:13]1.[CH3:22][c:23]1[n:24][c:25]([N:32]2[CH2:33][CH2:34][NH:35][CH2:36][CH2:37]2)[s:26][c:27]1[C:28]([F:29])([F:30])[F:31].[ClH:21]>>[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8]([O:14][CH:15]([C:16]([F:17])([F:18])[F:19])[CH3:20])[c:9]([C:10](=[O:12])[N:35]2[CH2:34][CH2:33][N:32]([c:25]3[n:24][c:23]([CH3:22])[c:27]([C:28]([F:29])([F:30])[F:31])[s:26]3)[CH2:37][CH2:36]2)[cH:13]1

Participants

4

Reactant 3

HCID 313Hydrochloric AcidHCID 211001784-Methyl-2-piperazin-1-yl-5-(trifluoromethyl)-1,3-thiazoleHCID 211003065-Methylsulfonyl-2-(2,2,2-trifluoro-1-methylethoxy)benzoic acid

Product 1

HCID 21100166[5-Methylsulfonyl-2-(1,1,1-trifluoropropan-2-yloxy)phenyl]-[4-[4-methyl-5-(trifluoromethyl)-1,3-thiazol-2-yl]piperazin-1-yl]methanone

Sources & evidence

ORD record
ord-92174fa058934c8aabe7d318aba6da90
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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