Acetonitrile → HCID 59444621, compound
Reaction equation
[CH3:25][C:26]#[N:27].[Cl:1][c:2]1[n:3][c:4](-[c:12]2[cH:13][cH:14][c:15]([CH2:18][CH3:19])[cH:16][cH:17]2)[cH:5][cH:6][c:7]1[C:8]([F:9])([F:10])[F:11].[F:28][C:29]([F:30])([F:31])[C:32]([OH:33])=[O:34].[NH2:20][CH2:21][CH2:22][CH2:23][OH:24]>>[c:2]1([NH:20][CH2:21][CH2:22][CH2:23][OH:24])[n:3][c:4](-[c:12]2[cH:13][cH:14][c:15]([CH2:18][CH3:19])[cH:16][cH:17]2)[cH:5][cH:6][c:7]1[C:8]([F:9])([F:10])[F:11]Participants
5
Sources & evidence
- ORD record
- ord-81c44f2fb03f447585dac3abf0417678
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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