Acetate → 5-(2-Chlorophenylthio)-6-(4-methylthiazol-2-ylamino)pyridin-3-ol

HRID 2315865Notes

Reaction equation

HRID 2315865 reaction equation
[Br:1][c:2]1[cH:3][c:4]([S:15][c:16]2[c:17]([Cl:22])[cH:18][cH:19][cH:20][cH:21]2)[c:5]([NH:8][c:9]2[s:10][cH:11][c:12]([CH3:14])[n:13]2)[n:6][cH:7]1.[CH3:23][C:24]1([CH3:26])[O:25][B:31]([B:32]2[O:33][C:34]([CH3:35])([CH3:36])[C:37]([CH3:38])([CH3:39])[O:40]2)[O:30][C:27]1([CH3:28])[CH3:29].[CH3:59][C:60]#[N:61].[CH:41]1([P:42]([CH:43]2[CH2:44][CH2:45][CH2:46][CH2:47]2)[CH:48]2[CH2:49][CH2:50][CH2:51][CH2:52]2)[CH2:53][CH2:54][CH2:55][CH2:56]1.[Cs+:58].[F-:57].[O-:63][C:64]([CH3:65])=[O:66].[O-:67][C:68]([CH3:69])=[O:70].[Pd+2:62]>>[c:2]1([OH:25])[cH:3][c:4]([S:15][c:16]2[c:17]([Cl:22])[cH:18][cH:19][cH:20][cH:21]2)[c:5]([NH:8][c:9]2[s:10][cH:11][c:12]([CH3:14])[n:13]2)[n:6][cH:7]1

Participants

9

Reactant 8

HCID 175Acetate2×HCID 6342AcetonitrileHCID 28179Fluoride IonHCID 104967Cesium cationHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 2733548Bis(pinacolato)diboraneHCID 4463278Phosphine, tricyclopentyl-HCID 24764526N-(5-bromo-3-(2-chlorophenylthio)pyridin-2-yl)-4-methylthiazol-2-amine

Product 1

HCID 247645195-(2-Chlorophenylthio)-6-(4-methylthiazol-2-ylamino)pyridin-3-ol

Sources & evidence

ORD record
ord-e23998cdaabc46f88ac64d74322b2055
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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