Ethanol → HCID 17774540, compound
Reaction equation
[CH3:23][CH2:24][NH2:25].[CH3:26][CH2:27][OH:28].[NH2:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[NH:11][c:12]2[n:13][c:14]([N:19]3[CH2:20][CH2:21][CH2:22]3)[n:15][c:16]([Cl:18])[cH:17]2)[cH:6][cH:7]1>>[NH2:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[NH:11][c:12]2[n:13][c:14]([N:19]3[CH2:20][CH2:21][CH2:22]3)[n:15][c:16]([NH:25][CH2:24][CH3:23])[cH:17]2)[cH:6][cH:7]1Participants
4
Sources & evidence
- ORD record
- ord-9b916e48b1f8431fa2e03efbd5686c86
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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