Acetonitrile → HCID 13933105, compound
Reaction equation
[CH2:30]1[CH2:31][CH2:32][C:33]2=[N:38][CH2:37][CH2:36][CH2:35][N:34]2[CH2:39][CH2:40]1.[CH3:21][NH:22][CH2:23][CH:24]1[CH2:25][NH:26][CH2:27][CH:28]1[CH3:29].[CH3:41][C:42]#[N:43].[CH:1]1([n:4]2[cH:5][c:6]([C:18](=[O:19])[OH:20])[c:7](=[O:17])[c:8]3[cH:9][c:10]([F:16])[c:11]([F:15])[c:12]([F:14])[c:13]23)[CH2:2][CH2:3]1>>[CH:1]1([n:4]2[cH:5][c:6]([C:18](=[O:19])[OH:20])[c:7](=[O:17])[c:8]3[cH:9][c:10]([F:16])[c:11]([N:26]4[CH2:25][CH:24]([CH2:23][NH:22][CH3:21])[CH:28]([CH3:29])[CH2:27]4)[c:12]([F:14])[c:13]23)[CH2:2][CH2:3]1Participants
5
Sources & evidence
- ORD record
- ord-cbf97570fbf843c5a2452b6a7bca68fb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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