Diisopropylamine → 2-(3-Chloro-4-methylsulfanyl-phenyl)-3-cyclopentyl-propionic acid ethyl ester

HRID 171208Notes

Reaction equation

HRID 171208 reaction equation
[CH2:13]([CH3:14])[O:15][C:16]([CH2:17][c:18]1[cH:19][c:20]([Cl:26])[c:21]([S:24][CH3:25])[cH:22][cH:23]1)=[O:27].[CH2:8]([Li:9])[CH2:10][CH2:11][CH3:12].[CH3:40][N:41]1[CH2:42][CH2:43][CH2:44][N:45]([CH3:46])[C:47]1=[O:48].[CH:1]([NH:2][CH:3]([CH3:4])[CH3:5])([CH3:6])[CH3:7].[I:28][CH2:29][CH:30]1[CH2:31][CH2:32][CH2:33][CH2:34]1.[O:35]1[CH2:36][CH2:37][CH2:38][CH2:39]1>>[CH2:13]([CH3:14])[O:15][C:16]([CH:17]([c:18]1[cH:19][c:20]([Cl:26])[c:21]([S:24][CH3:25])[cH:22][cH:23]1)[CH2:29][CH:30]1[CH2:31][CH2:32][CH2:33][CH2:34]1)=[O:27]

Participants

7

Reactant 6

HCID 7912DiisopropylamineHCID 8028TetrahydrofuranHCID 816462(1H)-Pyrimidinone, tetrahydro-1,3-dimethyl-HCID 2762531(Iodomethyl)cyclopentaneHCID 54095555(3-Chloro-4-methylsulfanyl-phenyl)-acetic acid ethyl esterHCID 178418339Butyllithium

Product 1

HCID 543204802-(3-Chloro-4-methylsulfanyl-phenyl)-3-cyclopentyl-propionic acid ethyl ester

Sources & evidence

ORD record
ord-1ec5f7265342418cba439cc83b450d7e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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