m-Chloroperbenzoic acid → tert-Butyl 5-(4-(4-bromophenyl)butanamido)-2-(isopropylsulfonyl)benzyl(methyl)carbamate

HRID 303873Notes

Reaction equation

HRID 303873 reaction equation
[Br:33][c:34]1[cH:35][cH:36][c:37]([CH2:40][CH2:41][CH2:42][C:43]([NH:44][c:45]2[cH:46][cH:47][c:48]([S:49][CH:50]([CH3:51])[CH3:52])[c:53]([CH2:55][N:56]([CH3:57])[C:58](=[O:59])[O:60][C:61]([CH3:62])([CH3:63])[CH3:64])[cH:54]2)=[O:65])[cH:38][cH:39]1.[OH:66][O:67][C:68]([c:69]1[cH:70][c:71]([Cl:72])[cH:73][cH:74][cH:75]1)=[O:76].[c:1]1([O:2][C:8]([NH:9][c:10]2[cH:11][c:12]([CH2:22][N:23]([CH3:24])[C:25](=[O:26])[O:27][C:28]([CH3:29])([CH3:30])[CH3:31])[c:13]([S:16](=[O:17])(=[O:18])[CH:19]([CH3:20])[CH3:21])[cH:14][cH:15]2)=[O:32])[cH:3][cH:4][cH:5][cH:6][cH:7]1>>[C:8]([NH:9][c:10]1[cH:11][c:12]([CH2:22][N:23]([CH3:24])[C:25](=[O:26])[O:27][C:28]([CH3:29])([CH3:30])[CH3:31])[c:13]([S:16](=[O:17])(=[O:18])[CH:19]([CH3:20])[CH3:21])[cH:14][cH:15]1)(=[O:32])[CH2:42][CH2:41][CH2:40][c:37]1[cH:36][cH:35][c:34]([Br:33])[cH:39][cH:38]1

Participants

4

Reactant 3

HCID 70297m-Chloroperbenzoic acidHCID 57842807tert-Butyl 5-(4-(4-bromophenyl)butanamido)-2-(isopropylthio)benzyl(methyl)carbamateHCID 57842905[3-[(tert-Butoxycarbonyl-methyl-amino)-methyl]-4-(propane-2-sulfonyl)-phenyl]-carbamic acid phenyl ester

Product 1

HCID 57842659tert-Butyl 5-(4-(4-bromophenyl)butanamido)-2-(isopropylsulfonyl)benzyl(methyl)carbamate

Sources & evidence

ORD record
ord-544320392b5b41eaa87bb3f709ddcf2e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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