Acetic Acid → HCID 178504908, compound
Reaction equation
[C:34]([OH:35])(=[O:36])[CH3:37].[CH3:26][S:27]([Cl:28])(=[O:29])=[O:30].[CH3:38][OH:39].[CH:1]12[CH2:2][CH:3]([NH:9][C:10](=[O:11])[N:12]3[CH2:13][CH:14]([NH:17][c:18]4[n:19][cH:20][c:21]([C:24]#[N:25])[cH:22][cH:23]4)[CH2:15][CH2:16]3)[CH2:4][CH:5]([CH2:6][CH2:7]1)[NH:8]2.[Cl:31][CH2:32][Cl:33]>>[CH:1]12[CH2:2][CH:3]([NH:9][C:10](=[O:11])[N:12]3[CH2:13][CH:14]([NH:17][c:18]4[n:19][cH:20][c:21]([C:24]#[N:25])[cH:22][cH:23]4)[CH2:15][CH2:16]3)[CH2:4][CH:5]([CH2:6][CH2:7]1)[N:8]2[S:27]([CH3:26])(=[O:29])=[O:30]Participants
6
Sources & evidence
- ORD record
- ord-f449dc6c630d4fe28072bbbdbd4309ba
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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