N-(2-Cyanophenyl)piperazine → HCID 25028145, compound
Reaction equation
[C:29](#[N:30])[c:31]1[c:32]([N:37]2[CH2:38][CH2:39][NH:40][CH2:41][CH2:42]2)[cH:33][cH:34][cH:35][cH:36]1.[O:1]=[C:2]1[N:3]([S:16](=[O:17])(=[O:18])[c:19]2[c:20]([C:25]([F:26])([F:27])[F:28])[cH:21][cH:22][cH:23][cH:24]2)[CH2:4][CH:5]([C:13](=[O:14])[OH:15])[N:6]1[c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1>>[O:1]=[C:2]1[N:3]([S:16](=[O:17])(=[O:18])[c:19]2[c:20]([C:25]([F:26])([F:27])[F:28])[cH:21][cH:22][cH:23][cH:24]2)[CH2:4][CH:5]([C:13](=[O:14])[N:40]2[CH2:39][CH2:38][N:37]([c:32]3[c:31]([C:29]#[N:30])[cH:36][cH:35][cH:34][cH:33]3)[CH2:42][CH2:41]2)[N:6]1[c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1Participants
3
Sources & evidence
- ORD record
- ord-3c26b5ed32be42a0bb2bfb4ae7f81353
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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