Dimethylformamide → 4-chloro-N-[5-chloro-2-(4-hydroxy-3,3-dimethylpiperidine-1-carbonyl)pyridin-3-yl]-3-(trifluoromethyl)benzenesulfonamide

HRID 109456Notes

Reaction equation

HRID 109456 reaction equation
[CH3:26][C:27]1([CH3:34])[CH2:28][NH:29][CH2:30][CH2:31][CH:32]1[OH:33].[CH:59]([N:60]([CH2:61][CH3:62])[CH:63]([CH3:64])[CH3:65])([CH3:66])[CH3:67].[Cl:1][c:2]1[cH:3][c:4]([NH:11][S:12](=[O:13])(=[O:14])[c:15]2[cH:16][c:17]([C:22]([F:23])([F:24])[F:25])[c:18]([Cl:21])[cH:19][cH:20]2)[c:5]([C:8](=[O:9])[OH:10])[n:6][cH:7]1.[O:68]=[CH:69][N:70]([CH3:71])[CH3:72].[P-:35]([F:36])([F:37])([F:38])([F:39])([F:40])[F:41].[n:42]1([O:43][C:44]([N:45]([CH3:46])[CH3:47])=[N+:48]([CH3:49])[CH3:50])[c:51]2[n:52][cH:53][cH:54][cH:55][c:56]2[n:57][n:58]1>>[Cl:1][c:2]1[cH:3][c:4]([NH:11][S:12](=[O:13])(=[O:14])[c:15]2[cH:16][c:17]([C:22]([F:23])([F:24])[F:25])[c:18]([Cl:21])[cH:19][cH:20]2)[c:5]([C:8](=[O:10])[N:29]2[CH2:28][C:27]([CH3:26])([CH3:34])[CH:32]([OH:33])[CH2:31][CH2:30]2)[n:6][cH:7]1

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 219737363,3-Dimethylpiperidin-4-olHCID 579420775-Chloro-3-(4-chloro-3-trifluoromethyl benzenesulfonylamino)-pyridine-2-carboxylic acid

Product 1

HCID 579422674-chloro-N-[5-chloro-2-(4-hydroxy-3,3-dimethylpiperidine-1-carbonyl)pyridin-3-yl]-3-(trifluoromethyl)benzenesulfonamide

Sources & evidence

ORD record
ord-902c24dcaefa47b6b7d9ad3488b12a79
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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