Dimethyl Sulfoxide → Mafoprazine

HRID 282151Notes

Reaction equation

HRID 282151 reaction equation
[C:3]([CH3:4])(=[O:5])[NH:6][c:7]1[cH:8][c:9]([O:14][CH3:15])[c:10]([OH:13])[cH:11][cH:12]1.[CH3:33][S:34]([CH3:35])=[O:36].[CH:37]([OH:38])([CH3:39])[CH3:40].[Cl:16][CH2:17][CH2:18][CH2:19][N:20]1[CH2:21][CH2:22][N:23]([c:26]2[c:27]([F:32])[cH:28][cH:29][cH:30][cH:31]2)[CH2:24][CH2:25]1.[Na+:2].[OH-:1]>>[C:3]([CH3:4])(=[O:5])[NH:6][c:7]1[cH:8][c:9]([O:14][CH3:15])[c:10]([O:13][CH2:17][CH2:18][CH2:19][N:20]2[CH2:21][CH2:22][N:23]([c:26]3[c:27]([F:32])[cH:28][cH:29][cH:30][cH:31]3)[CH2:24][CH2:25]2)[cH:11][cH:12]1

Participants

7

Reactant 6

HCID 679Dimethyl SulfoxideHCID 923Sodium ionHCID 961HydroxideHCID 3776IsopropanolHCID 30805943-MethoxyacetaminophenHCID 20481759HCID 20481759, compound

Product 1

HCID 71241Mafoprazine

Sources & evidence

ORD record
ord-ef70d79aa1ac4f69ba16718df3e08d68
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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