Ethanol → 4-[[2-[(4-Chlorophenyl)sulfonylamino]-3-(oxan-2-yloxy)propanoyl]amino]benzoic acid

HRID 175687Notes

Reaction equation

HRID 175687 reaction equation
[CH3:37][CH2:38][OH:39].[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[NH:11][CH:12]([C:13](=[O:14])[NH:15][c:16]2[cH:17][cH:18][c:19]([C:22](=[O:23])[O:24][CH2:25][CH3:26])[cH:20][cH:21]2)[CH2:27][O:28][CH:29]2[O:30][CH2:31][CH2:32][CH2:33][CH2:34]2)[cH:6][cH:7]1.[Na+:36].[OH-:35]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[NH:11][CH:12]([C:13](=[O:14])[NH:15][c:16]2[cH:17][cH:18][c:19]([C:22](=[O:23])[OH:24])[cH:20][cH:21]2)[CH2:27][O:28][CH:29]2[O:30][CH2:31][CH2:32][CH2:33][CH2:34]2)[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 19032774(RS)-2-(4-chlorobenzenesulfonylamino)-N-(4-ethoxycarbonylphenyl)-3-(tetrahydropyran-2-yloxy)propanamide

Product 1

HCID 190327504-[[2-[(4-Chlorophenyl)sulfonylamino]-3-(oxan-2-yloxy)propanoyl]amino]benzoic acid

Sources & evidence

ORD record
ord-7d7076dc963243be8222d2cd696fee0d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

Loading…