Hydrochloric Acid → {4-[3-Cyclopentylmethoxy-5-(4-methanesulfonyl-phenylethynyl)-phenylsulfanyl]-2-methyl-phenoxy}-acetic Acid
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][O:6][c:7]1[c:8]([CH3:39])[cH:9][c:10]([S:13][c:14]2[cH:15][c:16]([O:32][CH2:33][CH:34]3[CH2:35][CH2:36][CH2:37][CH2:38]3)[cH:17][c:18]([C:20]#[C:21][c:22]3[cH:23][cH:24][c:25]([S:28](=[O:29])(=[O:30])[CH3:31])[cH:26][cH:27]3)[cH:19]2)[cH:11][cH:12]1)=[O:40].[CH3:44][CH2:45][OH:46].[ClH:43].[Na+:42].[OH-:41]>>[O:3]=[C:4]([CH2:5][O:6][c:7]1[c:8]([CH3:39])[cH:9][c:10]([S:13][c:14]2[cH:15][c:16]([O:32][CH2:33][CH:34]3[CH2:35][CH2:36][CH2:37][CH2:38]3)[cH:17][c:18]([C:20]#[C:21][c:22]3[cH:23][cH:24][c:25]([S:28](=[O:29])(=[O:30])[CH3:31])[cH:26][cH:27]3)[cH:19]2)[cH:11][cH:12]1)[OH:40]Participants
6
Sources & evidence
- ORD record
- ord-0675d69bdfae45d2aa871b6fbdf5995e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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