Ammonium → 5-[4-(2-Bromo-5-fluorophenoxy)piperidin-1-yl]-1,3,4-thiadiazole-2-carbonitrile
Reaction equation
[Br:1][c:2]1[c:3]([O:4][CH:5]2[CH2:6][CH2:7][NH:8][CH2:9][CH2:10]2)[cH:11][c:12]([F:15])[cH:13][cH:14]1.[Br:25][c:26]1[n:27][n:28][c:29]([C:31]#[N:32])[s:30]1.[CH2:35]1[O:36][CH2:37][CH2:38][O:39][CH2:40]1.[CH:16]([N:17]([CH2:18][CH3:19])[CH:20]([CH3:21])[CH3:22])([CH3:23])[CH3:24].[Cl-:33].[NH4+:34]>>[Br:1][c:2]1[c:3]([O:4][CH:5]2[CH2:6][CH2:7][N:8]([c:26]3[n:27][n:28][c:29]([C:31]#[N:32])[s:30]3)[CH2:9][CH2:10]2)[cH:11][c:12]([F:15])[cH:13][cH:14]1Participants
7
Sources & evidence
- ORD record
- ord-763ba14d10dc44b6b40501406f1a7dfa
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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