Ammonium → 3-Cyclopentyl-2-(2,3-dihydro-benzo[b]thiophen-5-yl)-propionic acid methyl ester
Reaction equation
[C:27]([O:28][C:29](=[O:30])[NH:31][c:32]1[cH:33][cH:34][cH:35][c:36]([CH2:37][n:38]2[cH:39][cH:40][c:41]([NH:42][C:43](=[O:44])[CH:45]([c:46]3[cH:47][cH:48][c:55]([S:56]([CH3:57])(=[O:58])=[O:59])[c:60]([Cl:61])[cH:62]3)[CH2:49][CH:50]3[CH2:51][CH2:52][CH2:53][CH2:54]3)[n:63]2)[cH:64]1)([CH3:65])([CH3:66])[CH3:67].[CH2:8]([Li:9])[CH2:10][CH2:11][CH3:12].[CH3:13][O:14][C:15]([CH2:16][c:17]1[cH:18][c:19]2[c:20]([cH:24][cH:25]1)[S:21][CH2:22][CH2:23]2)=[O:26].[CH:1]([NH:2][CH:3]([CH3:4])[CH3:5])([CH3:6])[CH3:7].[Cl-:73].[NH4+:74].[O:68]1[CH2:69][CH2:70][CH2:71][CH2:72]1>>[CH3:13][O:14][C:15]([CH:16]([c:17]1[cH:18][c:19]2[c:20]([cH:24][cH:25]1)[S:21][CH2:22][CH2:23]2)[CH2:49][CH:50]1[CH2:51][CH2:52][CH2:53][CH2:54]1)=[O:26]Participants
8
Reactant 7
HCID 223Ammonium
HCID 312Chloride
HCID 7912Diisopropylamine
HCID 8028Tetrahydrofuran
HCID 67190450tert-butyl N-[3-[[3-[[2-(3-chloro-4-methylsulfonylphenyl)-3-cyclopentylpropanoyl]amino]pyrazol-1-yl]methyl]phenyl]carbamate
HCID 67190969(2,3-Dihydro-benzo[b]thiophen-5-yl)-acetic acid methyl ester
HCID 178418339ButyllithiumProduct 1
Sources & evidence
- ORD record
- ord-e3c2dd94a882495cb21392d0cca7d953
- Source dataset
- Validation data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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