Trifluoroacetic acid → HCID 178466864, compound

HRID 1220862Notes

Reaction equation

HRID 1220862 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.[F:21][C:22]([F:23])([F:24])[C:25]([OH:26])=[O:27].[F:28][C:29]([c:30]1[n:31][n:32][c:33]([N:35]2[CH2:36][CH2:37][NH:38][CH2:39][CH2:40]2)[s:34]1)([F:41])[F:42]>>[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:38]2[CH2:37][CH2:36][N:35]([c:33]3[n:32][n:31][c:30]([C:29]([F:28])([F:41])[F:42])[s:34]3)[CH2:40][CH2:39]2)[cH:13]1

Participants

4

Reactant 3

HCID 6422Trifluoroacetic acidHCID 21460691-[5-(Trifluoromethyl)-1,3,4-thiadiazol-2-YL]piperazineHCID 211003065-Methylsulfonyl-2-(2,2,2-trifluoro-1-methylethoxy)benzoic acid

Product 1

HCID 178466864HCID 178466864, compound

Sources & evidence

ORD record
ord-963fb7ccfce94d0baa2f8dfff9318a64
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

Loading…