Acetate → HCID 68582659, compound
Reaction equation
[CH3:26][C:27]#[N:28].[CH3:30][C:31](=[O:32])[O-:33].[Cl:1][c:2]1[c:3]([C:9](=[O:10])[NH:11][CH:12]2[CH2:13][CH2:14][N:15]([c:18]3[n:19][n:20][c:21]([C:23]([OH:24])=[O:25])[s:22]3)[CH2:16][CH2:17]2)[nH:4][c:5]([CH3:8])[c:6]1[Cl:7].[NH4+:29]>>[Cl:1][c:2]1[c:3]([C:9](=[O:10])[NH:11][CH:12]2[CH2:13][CH2:14][N:15]([c:18]3[n:19][n:20][cH:21][s:22]3)[CH2:16][CH2:17]2)[nH:4][c:5]([CH3:8])[c:6]1[Cl:7]Participants
5
Sources & evidence
- ORD record
- ord-8d1d9eb0ead34bd49ff6d9ca596af13f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
Loading…