Dimethyl Sulfoxide → HCID 72533183, compound

HRID 2323690Notes

Reaction equation

HRID 2323690 reaction equation
[CH2:1]1[CH:2]2[N:3]([CH2:4][CH:5]([CH2:7][OH:8])[NH:6]1)[CH2:9][CH2:10][NH:11][CH2:12]2.[CH3:55][S:56]([CH3:57])=[O:58].[F:19][C:20]([c:21]1[cH:22][c:23]([C:31]([C:32](=[O:33])[N:34]([CH3:35])[c:36]2[cH:37][n:38][c:39]([Cl:50])[cH:40][c:41]2-[c:42]2[c:43]([CH3:49])[cH:44][c:45]([F:48])[cH:46][cH:47]2)([CH3:51])[CH3:52])[cH:24][c:25]([C:27]([F:28])([F:29])[F:30])[cH:26]1)([F:53])[F:54].[K+:13].[K+:14].[O-:15][C:16]([O-:17])=[O:18]>>[CH2:1]1[CH:2]2[N:3]([CH2:4][CH:5]([CH2:7][OH:8])[NH:6]1)[CH2:9][CH2:10][N:11]([c:39]1[n:38][cH:37][c:36]([N:34]([C:32]([C:31]([c:23]3[cH:22][c:21]([C:20]([F:19])([F:53])[F:54])[cH:26][c:25]([C:27]([F:28])([F:29])[F:30])[cH:24]3)([CH3:51])[CH3:52])=[O:33])[CH3:35])[c:41](-[c:42]3[c:43]([CH3:49])[cH:44][c:45]([F:48])[cH:46][cH:47]3)[cH:40]1)[CH2:12]2

Participants

6

Reactant 5

HCID 679Dimethyl SulfoxideHCID 813Potassium Cation2×HCID 19660Carbonate IonHCID 235027842-(3,5-Bis(trifluoromethyl)phenyl)-N-(6-chloro-4-(4-fluoro-2-methylphenyl)pyrid-3-yl)-N,2-dimethylpropanamideHCID 72533145HCID 72533145, compound

Product 1

HCID 72533183HCID 72533183, compound

Sources & evidence

ORD record
ord-72aace632f954891af51c9c17d8d2e83
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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