Ethanol → HCID 178464027, compound
Reaction equation
[CH2:1]([CH3:2])[N:3]([CH2:4][CH2:5][n:6]1[c:7]([CH2:18][c:19]2[cH:20][cH:21][c:22]([O:25][C:26]([F:27])([F:28])[F:29])[cH:23][cH:24]2)[cH:8][c:9]2[cH:10][c:11]([N+:15]([O-:16])=[O:17])[cH:12][cH:13][c:14]12)[CH2:30][CH3:31].[CH3:33][S:34][C:35](=[NH:36])[c:37]1[s:38][cH:39][cH:40][cH:41]1.[CH3:42][CH2:43][OH:44].[CH3:45][CH2:46][O:47][CH2:48][CH3:49].[IH:32].[Pd:50]>>[CH2:1]([CH3:2])[N:3]([CH2:4][CH2:5][n:6]1[c:7]([CH2:18][c:19]2[cH:20][cH:21][c:22]([O:25][C:26]([F:27])([F:28])[F:29])[cH:23][cH:24]2)[cH:8][c:9]2[cH:10][c:11]([NH:15][C:35](=[NH:36])[c:37]3[s:38][cH:39][cH:40][cH:41]3)[cH:12][cH:13][c:14]12)[CH2:30][CH3:31]Participants
7
Sources & evidence
- ORD record
- ord-ba7584f3b19749bca5a382c1e38321ce
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
Loading…