7-Difluoromethyl-5-(4-trifluoromethyl-phenyl)-pyrazolo[1,5-a]pyrimidine-3-carboxylic acid → HCID 11997466, compound
Reaction equation
[F:1][CH:2]([c:3]1[cH:4][c:5](-[c:15]2[cH:16][cH:17][c:18]([C:21]([F:22])([F:23])[F:24])[cH:19][cH:20]2)[n:6][c:7]2[n:8]1[n:9][cH:10][c:11]2[C:12](=[O:13])[OH:14])[F:25].[OH:26][CH2:27][CH2:28][N:29]([S:30](=[O:31])(=[O:32])[c:33]1[s:34][c:35]([Cl:39])[c:36]([NH2:38])[cH:37]1)[CH2:40][CH2:41][OH:42]>>[F:1][CH:2]([c:3]1[cH:4][c:5](-[c:15]2[cH:16][cH:17][c:18]([C:21]([F:22])([F:23])[F:24])[cH:19][cH:20]2)[n:6][c:7]2[n:8]1[n:9][cH:10][c:11]2[C:12](=[O:14])[NH:38][c:36]1[c:35]([Cl:39])[s:34][c:33]([S:30]([N:29]([CH2:28][CH2:27][OH:26])[CH2:40][CH2:41][OH:42])(=[O:31])=[O:32])[cH:37]1)[F:25]Participants
3
Sources & evidence
- ORD record
- ord-454f5e88abdf48a0a495066c58cf5141
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
Loading…