Ethanol → HCID 86733080, compound
Reaction equation
[CH2:1]([O:3][C:4](=[O:2])[CH2:5][S:6][c:7]1[n:8][c:9]([NH:14][c:15]2[c:16]([CH3:22])[c:17]([CH3:21])[cH:18][cH:19][cH:20]2)[cH:10][c:11]([Cl:13])[n:12]1)[CH3:23].[CH3:27][CH2:28][OH:29].[NH2:25][NH2:26].[OH2:24].[OH2:30]>>[O:3]=[C:4]([CH2:5][S:6][c:7]1[n:8][c:9]([NH:14][c:15]2[c:16]([CH3:22])[c:17]([CH3:21])[cH:18][cH:19][cH:20]2)[cH:10][c:11]([Cl:13])[n:12]1)[NH:25][NH2:26]Participants
5
Sources & evidence
- ORD record
- ord-12fb32188bdd4b4a9572fdeca358eb4c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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