Trifluoroacetic acid → 2-acetylthiomethyl-hexahydro-3-oxo-1H-pyrazolo[1,2-a]pyridazine-5-carboxylic acid
Reaction equation
[C:1]([CH3:2])(=[O:3])[S:4][CH2:5][CH:6]1[C:7](=[O:22])[N:8]2[N:9]([CH2:10][CH2:11][CH2:12][CH:13]2[C:14](=[O:15])[O:16][C:17]([CH3:18])([CH3:19])[CH3:20])[CH2:21]1.[OH:23][C:24]([C:25]([F:26])([F:27])[F:28])=[O:29]>>[C:1]([CH3:2])(=[O:3])[S:4][CH2:5][CH:6]1[C:7](=[O:22])[N:8]2[N:9]([CH2:10][CH2:11][CH2:12][CH:13]2[C:14](=[O:15])[OH:16])[CH2:21]1Participants
3
Sources & evidence
- ORD record
- ord-8d530f676d1241b7b985d2d90fa317de
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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