Acetonitrile → HCID 59809700, compound
Reaction equation
[CH2:27]1[CH2:28][O:29][CH2:30][CH2:31][NH:32]1.[CH3:33][C:34]#[N:35].[Cl:1][CH2:2][CH2:3][C:4](=[O:5])[NH:6][c:7]1[s:8][c:9](-[c:13]2[n:14][c:15]([NH:19][c:20]3[cH:21][cH:22][c:23]([Cl:26])[cH:24][cH:25]3)[n:16][cH:17][cH:18]2)[c:10]([CH3:12])[n:11]1>>[CH2:2]([CH2:3][C:4](=[O:5])[NH:6][c:7]1[s:8][c:9](-[c:13]2[n:14][c:15]([NH:19][c:20]3[cH:21][cH:22][c:23]([Cl:26])[cH:24][cH:25]3)[n:16][cH:17][cH:18]2)[c:10]([CH3:12])[n:11]1)[N:32]1[CH2:27][CH2:28][O:29][CH2:30][CH2:31]1Participants
4
Sources & evidence
- ORD record
- ord-8d3c789f9dac43c38b3843f4385d9b5c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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