Sodium ion → 2-Amino-4-furan-2-yl-6-isopropenyl-pyrimidine-5-carbonitrile

HRID 96819Notes

Reaction equation

HRID 96819 reaction equation
[C:23](=[CH2:24])([CH3:25])[B:26]([OH:27])[OH:28].[NH2:1][c:2]1[n:3][c:4](-[c:18]2[o:19][cH:20][cH:21][cH:22]2)[c:5]([C:16]#[N:17])[c:6]([O:8][S:9]([C:10]([F:11])([F:12])[F:13])(=[O:14])=[O:15])[n:7]1.[Na+:29].[Na+:30].[O-:31][C:32](=[O:33])[O-:34].[O:36]1[CH2:37][CH2:38][O:39][CH2:40][CH2:41]1.[OH2:35]>>[NH2:1][c:2]1[n:3][c:4](-[c:18]2[o:19][cH:20][cH:21][cH:22]2)[c:5]([C:16]#[N:17])[c:6]([C:23](=[CH2:24])[CH3:25])[n:7]1

Participants

7

Reactant 6

HCID 923Sodium ion2×HCID 962WaterHCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 10855372(Prop-1-en-2-yl)boronic acidHCID 86583747Trifluoromethanesulfonic acid 2-amino-5-cyano-6-furan-2-yl-pyrimidin-4-yl ester

Product 1

HCID 185073502-Amino-4-furan-2-yl-6-isopropenyl-pyrimidine-5-carbonitrile

Sources & evidence

ORD record
ord-b2cf6485eb9643aead333cb0147c9c42
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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