2-Bromo-4-(bromomethyl)-1-chlorobenzene → 6-(3-bromo-4-chloro-benzylthio)-3-tert-butoxycarbonyl-7-chloro-2,3,4,5-tetrahydro-1H-benzo[d]azepine

HRID 2131347Notes

Reaction equation

HRID 2131347 reaction equation
[Br:26][c:27]1[c:28]([Cl:35])[cH:29][cH:30][c:31]([CH2:33][Br:34])[cH:32]1.[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][c:11]2[c:12]([c:15]([S:20][C:21](=[O:22])[N:23]([CH3:24])[CH3:25])[c:16]([Cl:19])[cH:17][cH:18]2)[CH2:13][CH2:14]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][c:11]2[c:12]([c:15]([S:20][CH2:21][c:31]3[cH:30][cH:29][c:28]([Cl:35])[c:27]([Br:26])[cH:32]3)[c:16]([Cl:19])[cH:17][cH:18]2)[CH2:13][CH2:14]1

Participants

3

Reactant 2

HCID 509986962-Bromo-4-(bromomethyl)-1-chlorobenzeneHCID 576559793-tert-butoxycarbonyl-7-chloro-6-dimethylaminocarbonylthio-2,3,4,5-tetrahydro-1H-benzo[d]azepine

Product 1

HCID 576561636-(3-bromo-4-chloro-benzylthio)-3-tert-butoxycarbonyl-7-chloro-2,3,4,5-tetrahydro-1H-benzo[d]azepine

Sources & evidence

ORD record
ord-21cddacce09b4ff5bd582992e4136518
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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