Hydrochloric Acid → 5-[4-(3,5-di-tert-butyl-4-hydroxy-phenylsulfanyl)-piperidine-1-sulfonyl]-1-methyl-1H-pyrrole-2-carboxylic acid methyl ester
Reaction equation
[C:2]([CH3:3])([CH3:4])([CH3:5])[c:6]1[c:7]([OH:23])[c:8]([C:19]([CH3:20])([CH3:21])[CH3:22])[cH:9][c:10]([S:12][CH:13]2[CH2:14][CH2:15][NH:16][CH2:17][CH2:18]2)[cH:11]1.[CH2:47]1[O:48][CH2:49][CH2:50][CH2:51]1.[CH3:33][O:34][C:35](=[O:36])[c:37]1[n:38]([CH3:46])[c:39]([S:42](=[O:43])(=[O:44])[Cl:45])[cH:40][cH:41]1.[CH3:52][CH2:53][O:54][C:55](=[O:56])[CH3:57].[CH:24]([N:25]([CH2:26][CH3:27])[CH:28]([CH3:29])[CH3:30])([CH3:31])[CH3:32].[ClH:1]>>[C:2]([CH3:3])([CH3:4])([CH3:5])[c:6]1[c:7]([OH:23])[c:8]([C:19]([CH3:20])([CH3:21])[CH3:22])[cH:9][c:10]([S:12][CH:13]2[CH2:14][CH2:15][N:16]([S:42]([c:39]3[n:38]([CH3:46])[c:37]([C:35]([O:34][CH3:33])=[O:36])[cH:41][cH:40]3)(=[O:43])=[O:44])[CH2:17][CH2:18]2)[cH:11]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-b4a9f727bd36425fb610a340e9330d03
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
Loading…