Acetic Acid → 4-(1-Cyanocyclopentylamino)-2-fluorobenzonitrile
Reaction equation
[CH3:20][C:21](=[O:22])[OH:23].[NH2:4][c:5]1[cH:6][c:7]([F:13])[c:8]([C:9]#[N:10])[cH:11][cH:12]1.[Na:1][C:2]#[N:3].[O:14]=[C:15]1[CH2:16][CH2:17][CH2:18][CH2:19]1>>[C:2](#[N:3])[C:15]1([NH:4][c:5]2[cH:6][c:7]([F:13])[c:8]([C:9]#[N:10])[cH:11][cH:12]2)[CH2:16][CH2:17][CH2:18][CH2:19]1Participants
5
Sources & evidence
- ORD record
- ord-9b39360e03d24b01a71f5a568f4f79b3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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