Ethanol → {2-[5-{[6-(Methoxymethyl)pyridin-3-yl]oxy}-7-(tetrahydro-2H-pyran-4-yloxy)-1H-indol-2-yl]-4,5-dihydro-1,3-thiazol-5-yl}acetic acid

HRID 1133343Notes

Reaction equation

HRID 1133343 reaction equation
[CH2:1]([CH3:2])[CH:3]([C:4](=[O:5])[O-:6])[CH:7]1[CH2:8][N:9]=[C:10]([c:12]2[nH:13][c:14]3[c:15]([O:31][CH:32]4[CH2:33][CH2:34][O:35][CH2:36][CH2:37]4)[cH:16][c:17]([O:21][c:22]4[cH:23][n:24][c:25]([CH2:28][O:29][CH3:30])[cH:26][cH:27]4)[cH:18][c:19]3[cH:20]2)[S:11]1.[CH3:45][CH2:46][OH:47].[Na+:39].[O:40]1[CH2:41][CH2:42][CH2:43][CH2:44]1.[OH-:38]>>[CH2:3]([C:4](=[O:5])[OH:6])[CH:7]1[CH2:8][N:9]=[C:10]([c:12]2[nH:13][c:14]3[c:15]([O:31][CH:32]4[CH2:33][CH2:34][O:35][CH2:36][CH2:37]4)[cH:16][c:17]([O:21][c:22]4[cH:23][n:24][c:25]([CH2:28][O:29][CH3:30])[cH:26][cH:27]4)[cH:18][c:19]3[cH:20]2)[S:11]1

Participants

6

Reactant 5

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 8028TetrahydrofuranHCID 178454659HCID 178454659, compound

Product 1

HCID 66726112{2-[5-{[6-(Methoxymethyl)pyridin-3-yl]oxy}-7-(tetrahydro-2H-pyran-4-yloxy)-1H-indol-2-yl]-4,5-dihydro-1,3-thiazol-5-yl}acetic acid

Sources & evidence

ORD record
ord-e79f6d29fc8640f6a40689375e6d6034
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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