Acetonitrile → 2-Furan-2-yl-N5-[1-(5-methyl-isoxazol-3-ylmethyl)-piperidin-3-ylmethyl]-[1,2,4]triazolo[1,5-a][1,3,5]triazine-5,7-diamine
Reaction equation
[CH3:32][CH2:33][N:34]([CH2:35][CH3:36])[CH2:37][CH3:38].[CH3:39][C:40]#[N:41].[Cl:1][CH2:2][c:3]1[n:4][o:5][c:6]([CH3:8])[cH:7]1.[o:9]1[c:10](-[c:14]2[n:15][n:16]3[c:17]([n:18][c:19]([NH:23][CH2:24][CH:25]4[CH2:26][NH:27][CH2:28][CH2:29][CH2:30]4)[n:20][c:21]3[NH2:22])[n:31]2)[cH:11][cH:12][cH:13]1>>[CH2:2]([c:3]1[n:4][o:5][c:6]([CH3:8])[cH:7]1)[N:27]1[CH2:26][CH:25]([CH2:24][NH:23][c:19]2[n:18][c:17]3[n:16]([n:15][c:14](-[c:10]4[o:9][cH:13][cH:12][cH:11]4)[n:31]3)[c:21]([NH2:22])[n:20]2)[CH2:30][CH2:29][CH2:28]1Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-ddfc76fabec84473976acaa700b36e52
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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