Trifluoroacetic acid → [5-Methanesulfonyl-2-(2,2,3,3,3-pentafluoro-propoxy)-phenyl]-[4-(5-trifluoromethyl-[1,3,4]thiadiazol-2-yl)-piperazin-1-yl]-methanone

HRID 805609Notes

Reaction equation

HRID 805609 reaction equation
[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8]([O:14][CH2:15][C:16]([C:17]([F:18])([F:19])[F:20])([F:21])[F:22])[c:9]([C:10](=[O:11])[OH:12])[cH:13]1.[F:23][C:24]([F:25])([F:26])[C:27]([OH:28])=[O:29].[F:30][C:31]([c:32]1[n:33][n:34][c:35]([N:37]2[CH2:38][CH2:39][NH:40][CH2:41][CH2:42]2)[s:36]1)([F:43])[F:44]>>[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8]([O:14][CH2:15][C:16]([C:17]([F:18])([F:19])[F:20])([F:21])[F:22])[c:9]([C:10](=[O:11])[N:40]2[CH2:39][CH2:38][N:37]([c:35]3[n:34][n:33][c:32]([C:31]([F:30])([F:43])[F:44])[s:36]3)[CH2:42][CH2:41]2)[cH:13]1

Participants

4

Reactant 3

HCID 6422Trifluoroacetic acidHCID 21460691-[5-(Trifluoromethyl)-1,3,4-thiadiazol-2-YL]piperazineHCID 211003155-Methanesulfonyl-2-(2,2,3,3,3-pentafluoro-propoxy)-benzoic acid

Product 1

HCID 21100316[5-Methanesulfonyl-2-(2,2,3,3,3-pentafluoro-propoxy)-phenyl]-[4-(5-trifluoromethyl-[1,3,4]thiadiazol-2-yl)-piperazin-1-yl]-methanone

Sources & evidence

ORD record
ord-0500712ab9c34612ad5e430e85f4a7d2
Source dataset
Test data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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