Ethanethioic acid, S-(3-chloro-2-methyl-3-oxopropyl) ester → HCID 23347610, compound

HRID 2133632Notes

Reaction equation

HRID 2133632 reaction equation
[C:15]([S:16][CH2:17][CH:18]([CH3:19])[C:20]([Cl:21])=[O:22])(=[O:23])[CH3:24].[C:25]([S:26][CH2:27][CH:28]([CH3:29])[C:30](=[O:31])[N:38]1[C:39]([C:43](=[O:44])[OH:45])=[CH:40][CH2:41][CH2:42]1)(=[O:32])[c:33]1[cH:34][cH:35][cH:36][cH:37][cH:46]1.[s:1]1[c:2]([C:6](=[O:7])[S:8][CH2:9][CH:10]([C:11](=[O:12])[Cl:13])[CH3:14])[cH:3][cH:4][cH:5]1>>[s:1]1[c:2]([C:6](=[O:7])[S:8][CH2:9][CH:10]([C:11](=[O:12])[N:38]2[C:39]([C:43](=[O:44])[OH:45])=[CH:40][CH2:41][CH2:42]2)[CH3:14])[cH:3][cH:4][cH:5]1

Participants

4

Reactant 3

HCID 103458Ethanethioic acid, S-(3-chloro-2-methyl-3-oxopropyl) esterHCID 23347609(+/-)-1-[3-(benzoylthio)-2-methyl-1-oxopropyl]-4,5-dihydro-1H-pyrrole-2-carboxylic acidHCID 23347611HCID 23347611, compound

Product 1

HCID 23347610HCID 23347610, compound

Sources & evidence

ORD record
ord-c67fc00ae6824da6a6c044dfbbe39d2a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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