Trifluoroacetic acid → HCID 178449573, compound
Reaction equation
[CH3:1][C:2]([CH3:3])([CH3:4])[NH:5][C:6](=[O:7])[CH:8]1[N:9]([CH2:21][CH:22]([CH:23]([CH2:24][c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[NH:31][C:32](=[O:33])[CH:34]([CH:35]([CH3:36])[CH3:37])[NH:38][C:39]([N:40]([CH2:41][c:42]2[cH:43][n:44][cH:45][s:46]2)[CH3:47])=[O:48])[OH:49])[CH2:10][CH2:11][N:12]([C:14]([O:15][C:16]([CH3:17])([CH3:18])[CH3:19])=[O:20])[CH2:13]1.[OH:50][C:51]([C:52]([F:53])([F:54])[F:55])=[O:56].[s:57]1[cH:58][n:59][cH:60][c:61]1[Cl:62]>>[CH3:1][C:2]([CH3:3])([CH3:4])[NH:5][C:6](=[O:7])[CH:8]1[N:9]([CH2:21][CH:22]([CH:23]([CH2:24][c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[NH:31][C:32](=[O:33])[CH:34]([CH:35]([CH3:36])[CH3:37])[NH:38][C:39]([N:40]([CH2:41][c:42]2[cH:43][n:44][cH:45][s:46]2)[CH3:47])=[O:48])[OH:49])[CH2:10][CH2:11][N:12]([CH2:14][c:61]2[s:57][cH:58][n:59][cH:60]2)[CH2:13]1Participants
4
Sources & evidence
- ORD record
- ord-b0f8418c89df49fd8ddd0e17c57dc41f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
Loading…