Hydrochloric Acid → 3'-Fluoro-4'-(hexadecylamino)-2-(phenylsulfonyl)acetophenone
Reaction equation
[CH3:3][S:4](=[O:5])(=[O:6])[c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1.[CH3:47][O:48][CH2:49][CH2:50][O:51][CH3:52].[ClH:41].[F:13][c:14]1[cH:15][c:16]([C:17](=[O:18])[O:19][CH3:20])[cH:21][cH:22][c:23]1[NH:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH3:40].[H-:1].[Na+:2].[O:42]1[CH2:43][CH2:44][CH2:45][CH2:46]1>>[CH2:3]([S:4](=[O:5])(=[O:6])[c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1)[C:17]([c:16]1[cH:15][c:14]([F:13])[c:23]([NH:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH3:40])[cH:22][cH:21]1)=[O:18]Participants
8
Sources & evidence
- ORD record
- ord-3ad73cabae584965908a4b821fb56f0e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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