Hexane → HCID 19021746, compound
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[NH:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][S:14][c:15]1[nH:16][c:17](-[c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[c:18](-[c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[n:19]1.[CH3:43][CH2:44][CH2:45][CH2:46][CH2:47][CH3:48].[F:32][c:33]1[c:34]([N:40]=[C:41]=[O:42])[cH:35][cH:36][c:37]([F:39])[cH:38]1>>[CH2:1]([CH2:2][CH2:3][CH3:4])[N:5]([CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][S:14][c:15]1[n:16][c:17](-[c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[c:18](-[c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[nH:19]1)[C:41]([NH:40][c:34]1[c:33]([F:32])[cH:38][c:37]([F:39])[cH:36][cH:35]1)=[O:42]Participants
4
Sources & evidence
- ORD record
- ord-a6c8b5ae27a547b2b02e4b3ccadbf34d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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