Ethanol → HCID 178464032, compound
Reaction equation
[CH2:11]([CH3:12])[N:13]([CH2:14][CH2:15][N:16]1[c:17]2[c:18]([cH:22][c:23]([NH2:26])[cH:24][cH:25]2)[S:19][CH2:20][CH2:21]1)[CH2:27][CH3:28].[CH3:29][CH2:30][OH:31].[IH:1].[s:2]1[c:3]([C:7](=[NH:8])[S:9][CH3:10])[cH:4][cH:5][cH:6]1>>[s:2]1[c:3]([C:7](=[NH:8])[NH:26][c:23]2[cH:22][c:18]3[c:17]([cH:25][cH:24]2)[N:16]([CH2:15][CH2:14][N:13]([CH2:11][CH3:12])[CH2:27][CH3:28])[CH2:21][CH2:20][S:19]3)[cH:4][cH:5][cH:6]1Participants
5
Sources & evidence
- ORD record
- ord-730d6a2e01c94eb78666153795dc7bca
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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