Dimethylformamide → 2-Amino-4-(4,5-dihydro-furan-2-yl)-6-(2-pyridin-2-yl-ethylsulfanyl)-pyrimidine-5-carbonitrile

HRID 304502Notes

Reaction equation

HRID 304502 reaction equation
[CH2:27]([Sn:28]([CH2:29][CH2:30][CH2:31][CH3:37])([C:32]1=[CH:36][CH2:35][CH2:34][O:33]1)[CH2:38][CH2:39][CH2:40][CH3:41])[CH2:42][CH2:43][CH3:44].[NH2:1][c:2]1[n:3][c:4]([S:18][CH2:19][CH2:20][c:21]2[n:22][cH:23][cH:24][cH:25][cH:26]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.[O:45]1[CH2:46][CH2:47][O:48][CH2:49][CH2:50]1.[O:51]=[CH:52][N:53]([CH3:54])[CH3:55]>>[NH2:1][c:2]1[n:3][c:4]([S:18][CH2:19][CH2:20][c:21]2[n:22][cH:23][cH:24][cH:25][cH:26]2)[c:5]([C:16]#[N:17])[c:6]([C:32]2=[CH:36][CH2:35][CH2:34][O:33]2)[n:7]1

Participants

5

Reactant 4

HCID 6228DimethylformamideHCID 312751,4-DioxaneHCID 14323397Tributyl(2,3-dihydrofuran-5-yl)stannaneHCID 86583756Trifluoromethanesulfonic acid 2-amino-5-cyano-6-(2-pyridin-2-yl-ethylsulfanyl)-pyrimidin-4-yl ester

Product 1

HCID 185072422-Amino-4-(4,5-dihydro-furan-2-yl)-6-(2-pyridin-2-yl-ethylsulfanyl)-pyrimidine-5-carbonitrile

Sources & evidence

ORD record
ord-f4fc88e91d86439d9035cdba124d21b0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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