Acetonitrile → HCID 68779242, compound
Reaction equation
[C:18]([CH3:19])([CH3:20])([CH3:21])[O:22][C:23](=[O:24])[N:25]1[CH2:26][CH2:27][CH:28]([NH2:31])[CH2:29][CH2:30]1.[CH3:32][CH2:33][N:34]([CH2:35][CH3:36])[CH2:37][CH3:38].[CH3:39][C:40]([N:41]([CH3:42])[CH3:43])=[O:44].[CH3:45][C:46]#[N:47].[Cl:1][c:2]1[n:3][c:4]2[n:5][cH:6][cH:7][n:8][c:9]2[c:10](-[c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[n:11]1>>[c:2]1([NH:31][CH:28]2[CH2:27][CH2:26][N:25]([C:23]([O:22][C:18]([CH3:19])([CH3:20])[CH3:21])=[O:24])[CH2:30][CH2:29]2)[n:3][c:4]2[n:5][cH:6][cH:7][n:8][c:9]2[c:10](-[c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[n:11]1Participants
6
Sources & evidence
- ORD record
- ord-5085fb593d474187b0ffc56667ba4da9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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