Ethanol → 5-Cyano-N-(1H-indol-1-yl)-4-pyrimidinamine
Reaction equation
[CH3:1][CH2:2][OH:3].[CH3:23][CH2:24][N:25]([CH2:26][CH3:27])[CH2:28][CH3:29].[Cl:14][c:15]1[n:16][cH:17][n:18][cH:19][c:20]1[C:21]#[N:22].[OH2:30].[n:4]1([NH2:13])[cH:5][cH:6][c:7]2[cH:8][cH:9][cH:10][cH:11][c:12]12>>[n:4]1([NH:13][c:15]2[n:16][cH:17][n:18][cH:19][c:20]2[C:21]#[N:22])[cH:5][cH:6][c:7]2[cH:8][cH:9][cH:10][cH:11][c:12]12Participants
6
Sources & evidence
- ORD record
- ord-3074bd412d4c4b9a9a89868a9f483950
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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