Acetonitrile → HCID 14209973, compound
Reaction equation
[C:23]([O:24][CH2:25][CH3:26])(=[O:27])[CH3:28].[CH3:20][C:21]#[N:22].[Cl:29][CH2:30][Cl:31].[NH2:1][c:2]1[c:3]([C:4](=[O:5])[NH:6][c:7]2[c:8]([Cl:13])[n:9][cH:10][cH:11][cH:12]2)[cH:14][c:15]([CH2:18][CH3:19])[cH:16][cH:17]1.[S:32]1(=[O:37])(=[O:38])[CH2:33][CH2:34][CH2:35][CH2:36]1>>[NH:1]1[c:2]2[c:3]([cH:14][c:15]([CH2:18][CH3:19])[cH:16][cH:17]2)[C:4](=[O:5])[NH:6][c:7]2[c:8]1[n:9][cH:10][cH:11][cH:12]2Participants
6
Sources & evidence
- ORD record
- ord-fa2f9ebae7ff4a38823439b36c322d20
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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