Acetic Acid → Ethyl 2-bromo-4,5,7,8-tetrahydro-6H-thieno[2,3-d]azepine-6-carboxylate

Reaction equation

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

Participants

Reactant 4

HCID 176Acetic Acid

HCID 6212Chloroform

HCID 67184N-bromobutanimide

HCID 593025414,5,7,8-Tetrahydro-thieno[2,3-d]azepine-6-carboxylic acid ethyl ester

Product 1

HCID 57354995Ethyl 2-bromo-4,5,7,8-tetrahydro-6H-thieno[2,3-d]azepine-6-carboxylate

Sources & evidence

ORD record: ord-e8eeceefd5354e9b85bf4900eaa266b7
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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