Acetonitrile → HCID 15521237, compound
Reaction equation
[CH3:23][c:24]1[cH:25][cH:26][c:27]([CH2:28][NH:29][CH2:30][CH2:31][CH2:32][OH:33])[cH:34][cH:35]1.[CH3:36][C:37]#[N:38].[Cl:1][c:2]1[c:3]2[c:4]([n:5][c:6]([CH3:8])[n:7]1)[n:9](-[c:14]1[c:15]([Cl:22])[cH:16][c:17]([Cl:21])[cH:18][c:19]1[Cl:20])[n:10][c:11]2[S:12][CH3:13]>>[c:2]1([N:29]([CH2:28][c:27]2[cH:26][cH:25][c:24]([CH3:23])[cH:35][cH:34]2)[CH2:30][CH2:31][CH2:32][OH:33])[c:3]2[c:4]([n:5][c:6]([CH3:8])[n:7]1)[n:9](-[c:14]1[c:15]([Cl:22])[cH:16][c:17]([Cl:21])[cH:18][c:19]1[Cl:20])[n:10][c:11]2[S:12][CH3:13]Participants
4
Sources & evidence
- ORD record
- ord-39f3e33ec8e740f99aa03999b866dba5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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