Ethanol → HCID 178477672, compound
Reaction equation
[CH3:25][CH2:26][N:27]([CH2:28][CH3:29])[CH2:30][CH3:31].[CH3:47][CH2:48][OH:49].[Cl:32][c:33]1[n:34][cH:35][n:36][c:37]2[cH:38][cH:39][c:40]([C:43]([F:44])([F:45])[F:46])[cH:41][c:42]12.[NH2:1][CH:2]1[C:3](=[O:24])[N:4]([CH:7]2[CH:8]([CH2:18][S:19](=[O:20])(=[O:21])[CH2:22][CH3:23])[CH2:9][CH:10]([N:13]([CH3:14])[CH:15]([CH3:16])[CH3:17])[CH2:11][CH2:12]2)[CH2:5][CH2:6]1>>[NH:1]([CH:2]1[C:3](=[O:24])[N:4]([CH:7]2[CH:8]([CH2:18][S:19](=[O:20])(=[O:21])[CH2:22][CH3:23])[CH2:9][CH:10]([N:13]([CH3:14])[CH:15]([CH3:16])[CH3:17])[CH2:11][CH2:12]2)[CH2:5][CH2:6]1)[c:33]1[n:34][cH:35][n:36][c:37]2[cH:38][cH:39][c:40]([C:43]([F:44])([F:45])[F:46])[cH:41][c:42]12Participants
5
Sources & evidence
- ORD record
- ord-abdc07d38e4f42f8b5ac3ec7b5562313
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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