Ethanol → o-Desethyl sildenafil

HRID 1571165Notes

Reaction equation

HRID 1571165 reaction equation
[CH3:26][N:27]1[CH2:28][CH2:29][NH:30][CH2:31][CH2:32]1.[CH3:33][CH2:34][OH:35].[Cl:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8]([OH:25])[c:9](-[c:11]2[nH:12][c:13](=[O:24])[c:14]3[c:15]([n:16]2)[c:17]([CH2:21][CH2:22][CH3:23])[n:18][n:19]3[CH3:20])[cH:10]1>>[S:2](=[O:3])(=[O:4])([c:5]1[cH:6][cH:7][c:8]([OH:25])[c:9](-[c:11]2[nH:12][c:13](=[O:24])[c:14]3[c:15]([n:16]2)[c:17]([CH2:21][CH2:22][CH3:23])[n:18][n:19]3[CH3:20])[cH:10]1)[N:30]1[CH2:29][CH2:28][N:27]([CH3:26])[CH2:32][CH2:31]1

Participants

4

Reactant 3

HCID 702EthanolHCID 531671-MethylpiperazineHCID 135738545Demethylpiperazinyl Desethyl Sildenafil Sulfonyl Chloride

Product 1

HCID 135565516o-Desethyl sildenafil

Sources & evidence

ORD record
ord-79422515fb544ad89d7ca4dd1fc75523
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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