Ethanol → HCID 178482569, compound
Reaction equation
[CH3:11][N:12]([c:13]1[cH:14][c:15]2[c:16]3[c:17]([cH:25]1)[C:18]([SH:24])=[N:19][c:20]3[cH:21][cH:22][cH:23]2)[CH3:26].[CH3:27][CH2:28][OH:29].[n:1]1[cH:2][c:3]([CH2:7][CH2:8][CH2:9][NH2:10])[cH:4][cH:5][cH:6]1>>[n:1]1[cH:2][c:3]([CH2:7][CH2:8][CH2:9][NH:10][C:18]2=[N:19][c:20]3[c:16]4[c:15]([cH:14][c:13]([N:12]([CH3:11])[CH3:26])[cH:25][c:17]42)[cH:23][cH:22][cH:21]3)[cH:4][cH:5][cH:6]1Participants
4
Sources & evidence
- ORD record
- ord-4e99f1d2675544c9b0023fd41abea7a8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
Loading…