Dimethyl Sulfoxide → N-(4-tert-butylbenzyl)-2-hydroxy-2-(5-isoquinolinyl)acetamide

HRID 1127484Notes

Reaction equation

HRID 1127484 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([CH2:9][NH2:10])[cH:11][cH:12]1.[CH3:42][OH:43].[CH3:44][S:45]([CH3:46])=[O:47].[OH:13][CH:14]([C:15](=[O:16])[OH:17])[c:18]1[c:19]2[cH:20][cH:21][n:22][cH:23][c:24]2[cH:25][cH:26][cH:27]1.[cH:28]1[c:29]2[c:30]([c:31]([CH2:32][C:33]([OH:34])=[O:35])[cH:36][cH:37][cH:38]2)[cH:39][cH:40][n:41]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([CH2:9][NH:10][C:15]([CH:14]([OH:13])[c:18]2[c:19]3[cH:20][cH:21][n:22][cH:23][c:24]3[cH:25][cH:26][cH:27]2)=[O:16])[cH:11][cH:12]1

Participants

6

Reactant 5

HCID 679Dimethyl SulfoxideHCID 887MethanolHCID 27356554-tert-ButylbenzylamineHCID 120187082-(Isoquinolin-5-YL)acetic acidHCID 223376972-Hydroxy-2-(isoquinolin-5-yl)acetic acid

Product 1

HCID 11291000N-(4-tert-butylbenzyl)-2-hydroxy-2-(5-isoquinolinyl)acetamide

Sources & evidence

ORD record
ord-b4ea38afce70431d8313435e94949c13
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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