Acetic Acid → HCID 178513450, compound
Reaction equation
[C:15]([OH:16])(=[O:17])[CH3:18].[C:19]([OH:20])(=[O:21])[CH3:22].[CH2:30]1[O:31][CH2:32][CH2:33][CH2:34]1.[Cl:1][c:2]1[n:3][cH:4][c:5]([CH2:9][S:10][CH3:11])[cH:6][c:7]1[F:8].[I:23][c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1.[NH2:12][C:13]#[N:14]>>[Cl:1][c:2]1[n:3][cH:4][c:5]([CH2:9][SH:10]=[N:14][C:13]#[N:12])[cH:6][c:7]1[F:8]Participants
6
Sources & evidence
- ORD record
- ord-9f19dd31989e4d3daac1b2adc6d69600
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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