Isopropanol → HCID 69844698, compound
Reaction equation
[CH2:19]1[CH2:20][CH2:21][NH:22][CH2:23][CH2:24]1.[CH3:25][CH:26]([OH:27])[CH3:28].[O:1]=[C:2]1[CH2:3][c:4]2[c:5]([s:7][c:8]([C:10]#[N:11])[cH:9]2)[NH:6]1.[nH:12]1[c:13]([CH:17]=[O:18])[cH:14][cH:15][cH:16]1>>[O:1]=[C:2]1[C:3](=[CH:17][c:13]2[nH:12][cH:16][cH:15][cH:14]2)[c:4]2[c:5]([s:7][c:8]([C:10]#[N:11])[cH:9]2)[NH:6]1Participants
5
Sources & evidence
- ORD record
- ord-ac6f5c3f53b04dda81ea34d5bf43f52f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
Loading…