Ammonia → Uxepam

HRID 669752Notes

Reaction equation

HRID 669752 reaction equation
[C:21]([OH:22])([O-:23])=[O:24].[CH3:1][N:2]1[C:3](=[O:20])[CH2:4][NH:5][CH:6]([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[c:7]2[c:8]1[cH:9][cH:10][c:11]([Cl:13])[cH:12]2.[CH3:37][OH:38].[Cl:26][C:27](=[O:28])[Cl:29].[NH3:30].[Na+:25].[cH:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1>>[CH3:1][N:2]1[C:3](=[O:20])[CH2:4][N:5]([C:21](=[O:24])[NH2:30])[CH:6]([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[c:7]2[c:8]1[cH:9][cH:10][c:11]([Cl:13])[cH:12]2

Participants

8

Reactant 7

HCID 222AmmoniaHCID 241BenzeneHCID 769Bicarbonate IonHCID 887MethanolHCID 923Sodium ionHCID 6371PhosgeneHCID 30819844,5-Dihydrodiazepam

Product 1

HCID 68787Uxepam

Sources & evidence

ORD record
ord-76047dea3a73429ea44dcf561941a4e4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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