Acetonitrile → 7-Furan-2-yl-N2-[1-(5-methyl-isoxazol-3-ylmethyl)-pyrrolidin-2-ylmethyl]-pyrazolo[1,5-a][1,3,5]triazine-2,4-diamine

HRID 2149475Notes

Reaction equation

HRID 2149475 reaction equation
[CH3:31][CH2:32][N:33]([CH2:34][CH3:35])[CH2:36][CH3:37].[CH3:38][C:39]#[N:40].[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[NH:26][CH2:27][CH2:28][CH2:29]4)[n:20][c:21]3[NH2:22])[cH:30]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:26]1[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)[cH:30]3)[c:21]([NH2:22])[n:20]2)[CH2:29][CH2:28][CH2:27]1

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 8471TriethylamineHCID 27357633-(Chloromethyl)-5-methyl-1,2-oxazoleHCID 694307307-Furan-2-yl-N2-pyrrolidin-2-ylmethyl-pyrazolo[1,5-a][1,3,5]triazine-2,4-diamine

Product 1

HCID 112231477-Furan-2-yl-N2-[1-(5-methyl-isoxazol-3-ylmethyl)-pyrrolidin-2-ylmethyl]-pyrazolo[1,5-a][1,3,5]triazine-2,4-diamine

Sources & evidence

ORD record
ord-17e9c20bd1bb445b81a39c28f598d47b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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