Acetonitrile → HCID 57559933, compound
Reaction equation
[Br:1][CH:2]([c:3]1[cH:4][c:5]([C:6]#[N:7])[cH:8][cH:9][cH:10]1)[c:11]1[cH:12][cH:13][c:14]([Cl:17])[cH:15][cH:16]1.[CH3:45][C:46]#[N:47].[CH:36]([N:37]([CH2:38][CH3:39])[CH:40]([CH3:41])[CH3:42])([CH3:43])[CH3:44].[NH:18]1[CH2:19][CH:20]([C:22]([C:23]([CH3:24])([CH3:25])[CH3:26])([OH:27])[c:28]2[cH:29][c:30]([F:35])[cH:31][c:32]([F:34])[cH:33]2)[CH2:21]1>>[CH:2]([c:3]1[cH:4][c:5]([C:6]#[N:7])[cH:8][cH:9][cH:10]1)([c:11]1[cH:12][cH:13][c:14]([Cl:17])[cH:15][cH:16]1)[N:18]1[CH2:19][CH:20]([C:22]([C:23]([CH3:24])([CH3:25])[CH3:26])([OH:27])[c:28]2[cH:29][c:30]([F:35])[cH:31][c:32]([F:34])[cH:33]2)[CH2:21]1Participants
5
Sources & evidence
- ORD record
- ord-50f02466ea5f4b32b4613167806e4bc8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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