Sodium Ion → Ethyl 2-(3-amino-4-oxo-2-phenyl-2,3-dihydro-1,5-benzothiazepin-5-yl)acetate

Reaction equation

[Br:22][CH2:23][C:24](=[O:25])[O:26][CH2:27][CH3:28].[CH3:29][N:30]([CH3:31])[CH:32]=[O:33].[H-:20].[NH2:1][CH:2]1[CH:3]([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[S:4][c:5]2[c:6]([cH:10][cH:11][cH:12][cH:13]2)[NH:7][C:8]1=[O:9].[Na+:21]>>[NH2:1][CH:2]1[CH:3]([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[S:4][c:5]2[c:6]([cH:10][cH:11][cH:12][cH:13]2)[N:7]([CH2:23][C:24](=[O:25])[O:26][CH2:27][CH3:28])[C:8]1=[O:9]

Participants

Reactant 5

HCID 923Sodium Ion

HCID 6228Dimethylformamide

HCID 7748Ethyl bromoacetate

HCID 166653Hydride

HCID 134905133-amino-2-phenyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one

Product 1

HCID 14648533Ethyl 2-(3-amino-4-oxo-2-phenyl-2,3-dihydro-1,5-benzothiazepin-5-yl)acetate

Sources & evidence

ORD record: ord-7eaca37ceb384610aa2d15f309a86086
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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