Dimethyl Sulfoxide → 4-(2-(5-(1,3-Dioxan-2-yl)pyridin-2-yl)thieno[3,2-b]pyridin-7-yloxy)-3-fluoroaniline

HRID 679428Notes

Reaction equation

HRID 679428 reaction equation
[CH3:10][C:11]([CH3:12])([O-:13])[CH3:14].[CH3:38][S:39]([CH3:40])=[O:41].[K+:15].[NH2:1][c:2]1[cH:3][c:4]([F:9])[c:5]([OH:8])[cH:6][cH:7]1.[O:16]1[CH:17]([c:22]2[cH:23][cH:24][c:25](-[c:28]3[cH:29][c:30]4[n:31][cH:32][cH:33][c:34]([Cl:37])[c:35]4[s:36]3)[n:26][cH:27]2)[O:18][CH2:19][CH2:20][CH2:21]1.[OH2:42]>>[NH2:1][c:2]1[cH:3][c:4]([F:9])[c:5]([O:8][c:34]2[cH:33][cH:32][n:31][c:30]3[cH:29][c:28](-[c:25]4[cH:24][cH:23][c:22]([CH:17]5[O:16][CH2:21][CH2:20][CH2:19][O:18]5)[cH:27][n:26]4)[s:36][c:35]32)[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 679Dimethyl SulfoxideHCID 813Potassium CationHCID 962WaterHCID 2735918Phenol, 4-amino-2-fluoro-HCID 45749132-Methylpropan-2-olateHCID 579672702-(5-(1,3-Dioxan-2-yl)pyridin-2-yl)-7-chlorothieno[3,2-b]pyridine

Product 1

HCID 579672584-(2-(5-(1,3-Dioxan-2-yl)pyridin-2-yl)thieno[3,2-b]pyridin-7-yloxy)-3-fluoroaniline

Sources & evidence

ORD record
ord-8eb88fcd3f5449c29448ef4923c7479f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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