Dimethyl Sulfoxide → HCID 12875685, compound

HRID 689981Notes

Reaction equation

HRID 689981 reaction equation
[C:27]([OH:28])(=[O:29])[C:30]([OH:31])=[O:32].[CH3:1][N:2]([CH3:3])[CH2:4][CH2:5][CH:6]([c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1)[OH:13].[CH3:33][S:34]([CH3:35])=[O:36].[CH3:37][CH2:38][O:39][C:40](=[O:41])[CH3:42].[F:16][c:17]1[cH:18][cH:19][c:20]([C:21]#[N:22])[cH:23][cH:24]1.[H-:14].[Na+:15].[OH2:25].[OH2:26].[OH2:43]>>[CH3:1][N:2]([CH3:3])[CH2:4][CH2:5][CH:6]([c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1)[O:13][c:17]1[cH:18][cH:19][c:20]([C:21]#[N:22])[cH:23][cH:24]1

Participants

9

Reactant 8

HCID 679Dimethyl SulfoxideHCID 923Sodium ionHCID 962Water3×HCID 971Oxalic AcidHCID 8857Ethyl AcetateHCID 145174-FluorobenzonitrileHCID 1106653-(Dimethylamino)-1-phenylpropan-1-olHCID 166653Hydride

Product 1

HCID 12875685HCID 12875685, compound

Sources & evidence

ORD record
ord-1dde456ca9184b63b81e6e2f2b33136f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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