proline dl-form → 3-Fluoro-4-(2-(4-methylpiperazin-1-yl)thieno[3,2-b]pyridin-7-yloxy)aniline

HRID 2138482Notes

Reaction equation

HRID 2138482 reaction equation
[CH3:20][N:21]1[CH2:22][CH2:23][NH:24][CH2:25][CH2:26]1.[CH3:43][S:44]([CH3:45])=[O:46].[Cu:41][I:42].[F:1][c:2]1[cH:3][c:4]([NH2:5])[cH:6][cH:7][c:8]1[O:9][c:10]1[c:11]2[c:12]([n:13][cH:14][cH:15]1)[cH:16][c:17]([I:19])[s:18]2.[K+:35].[K+:36].[NH:27]1[CH2:28][CH2:29][CH2:30][CH:31]1[C:32]([OH:33])=[O:34].[O-:37][C:38]([O-:39])=[O:40]>>[F:1][c:2]1[cH:3][c:4]([NH2:5])[cH:6][cH:7][c:8]1[O:9][c:10]1[c:11]2[c:12]([n:13][cH:14][cH:15]1)[cH:16][c:17]([N:24]1[CH2:23][CH2:22][N:21]([CH3:20])[CH2:26][CH2:25]1)[s:18]2

Participants

8

Reactant 7

HCID 614proline dl-formHCID 679Dimethyl SulfoxideHCID 813Potassium Cation2×HCID 19660Carbonate IonHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 531671-MethylpiperazineHCID 584749503-Fluoro-4-((2-iodothieno[3,2-b]pyridin-7-yl)oxy)aniline

Product 1

HCID 673478913-Fluoro-4-(2-(4-methylpiperazin-1-yl)thieno[3,2-b]pyridin-7-yloxy)aniline

Sources & evidence

ORD record
ord-4d17224210e940cca0ccf0ac59b5bf48
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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