Water → Ethyl 6-cyano-2-methyl-5-(pentan-3-ylamino)nicotinate
Reaction equation
[Br:1][c:2]1[n:3][c:4]([CH3:19])[c:5]([C:6](=[O:7])[O:8][CH2:9][CH3:10])[cH:11][c:12]1[NH:13][CH:14]([CH2:15][CH3:16])[CH2:17][CH3:18].[CH2:23]([Sn:24]([Cl:25])([CH2:26][CH2:27][CH2:28][CH3:29])[CH2:30][CH2:31][CH2:32][CH3:33])[CH2:34][CH2:35][CH3:36].[CH3:37][C:38]#[N:39].[Na:20][C:21]#[N:22].[OH2:40]>>[c:2]1([C:21]#[N:22])[n:3][c:4]([CH3:19])[c:5]([C:6](=[O:7])[O:8][CH2:9][CH3:10])[cH:11][c:12]1[NH:13][CH:14]([CH2:15][CH3:16])[CH2:17][CH3:18]Participants
6
Sources & evidence
- ORD record
- ord-e96a2a8477d14ebca126b6d11afcb40f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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