Chloride → 2-{4-[5-(4-Chlorophenyl)pyridin-2-ylethynyl]phenyl}ethyl methanesulfonate
Reaction equation
[CH3:2][S:3](=[O:4])(=[O:5])[OH:6].[CH3:37][CH2:38][N:39]([CH2:40][CH3:41])[CH2:42][CH3:43].[Cl-:1].[Cl:44][CH2:45][Cl:46].[Cl:7][c:8]1[cH:9][cH:10][c:11](-[c:14]2[cH:15][cH:16][c:17]([C:20]#[C:21][c:22]3[cH:23][cH:24][c:25]([CH2:28][CH2:29][OH:30])[cH:26][cH:27]3)[n:18][cH:19]2)[cH:12][cH:13]1.[OH2:47].[cH:31]1[cH:32][cH:33][n:34][cH:35][cH:36]1>>[CH3:2][S:3](=[O:4])(=[O:5])[O:6][CH2:29][CH2:28][c:25]1[cH:24][cH:23][c:22]([C:21]#[C:20][c:17]2[cH:16][cH:15][c:14](-[c:11]3[cH:10][cH:9][c:8]([Cl:7])[cH:13][cH:12]3)[cH:19][n:18]2)[cH:27][cH:26]1Participants
8
Sources & evidence
- ORD record
- ord-b4ca4635906e440cbfdf15520e76fb07
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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