Ammonium → N-[{(2-{4-[2-ethyl-5-(1-hydroxyethyl)-1H-benzimidazol-1-yl]phenyl}ethyl)amino]carbonyl}-4-methylbenzenesulfonamide

HRID 285263Notes

Reaction equation

HRID 285263 reaction equation
[BH4-:39].[C:1]([CH3:2])(=[O:3])[c:4]1[cH:5][c:6]2[c:7]([n:8](-[c:13]3[cH:14][cH:15][c:16]([CH2:19][CH2:20][NH:21][C:22](=[O:23])[NH:24][S:25](=[O:26])(=[O:27])[c:28]4[cH:29][cH:30][c:31]([CH3:34])[cH:32][cH:33]4)[cH:17][cH:18]3)[c:9]([CH2:11][CH3:12])[n:10]2)[cH:35][cH:36]1.[CH3:43][CH2:44][OH:45].[Cl-:41].[NH4+:42].[Na+:38].[Na+:40].[OH-:37].[OH2:46]>>[CH:1]([CH3:2])([OH:3])[c:4]1[cH:5][c:6]2[c:7]([n:8](-[c:13]3[cH:14][cH:15][c:16]([CH2:19][CH2:20][NH:21][C:22](=[O:23])[NH:24][S:25](=[O:26])(=[O:27])[c:28]4[cH:29][cH:30][c:31]([CH3:34])[cH:32][cH:33]4)[cH:17][cH:18]3)[c:9]([CH2:11][CH3:12])[n:10]2)[cH:35][cH:36]1

Participants

9

Reactant 8

HCID 223AmmoniumHCID 312ChlorideHCID 702EthanolHCID 923Sodium ion2×HCID 961HydroxideHCID 962WaterHCID 28123BorohydrideHCID 21875662HCID 21875662, compound

Product 1

HCID 21876255N-[{(2-{4-[2-ethyl-5-(1-hydroxyethyl)-1H-benzimidazol-1-yl]phenyl}ethyl)amino]carbonyl}-4-methylbenzenesulfonamide

Sources & evidence

ORD record
ord-415a6898f43c49e4840cbdb6a8ee03d6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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