Hydrochloric Acid → HCID 91101222, compound
Reaction equation
[CH2:2]([CH3:3])[S:4][CH2:5][c:6]1[cH:7][cH:8][c:9]([CH:12]([CH:13]([CH3:14])[NH2:15])[O:16][c:17]2[cH:18][c:19]3[cH:20][n:21][n:22](-[c:26]4[cH:27][cH:28][c:29]([F:32])[cH:30][cH:31]4)[c:23]3[cH:24][cH:25]2)[cH:10][cH:11]1.[CH3:33][N:34]([CH3:35])[C:36]([N:37]([CH3:38])[CH3:39])=[NH:40].[CH3:50][OH:51].[ClH:1].[F:41][C:42]([C:43](=[O:44])[O:45][CH2:46][CH3:47])([F:48])[F:49]>>[CH2:2]([CH3:3])[S:4][CH2:5][c:6]1[cH:7][cH:8][c:9]([CH:12]([CH:13]([CH3:14])[NH:15][C:43]([C:42]([F:41])([F:48])[F:49])=[O:44])[O:16][c:17]2[cH:18][c:19]3[cH:20][n:21][n:22](-[c:26]4[cH:27][cH:28][c:29]([F:32])[cH:30][cH:31]4)[c:23]3[cH:24][cH:25]2)[cH:10][cH:11]1Participants
6
Sources & evidence
- ORD record
- ord-25dc41a0fd57465b899db877a1bee1ff
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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