5,7-Dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carbaldehyde → 2-[4-(2-{2-Cyclopentyl-5-[(1,3-dimethyl-1H-1,2,4-triazol-5-yl)methyl]-4-hydroxy-6-oxo-3,6-dihydro-2H-pyran-2-yl}ethyl)-2-fluorophenyl]-2-methylpropanenitrile

HRID 308640Notes

Reaction equation

HRID 308640 reaction equation
[CH3:54][n:55]1[n:56][c:57]([CH3:62])[n:58][c:59]1[CH:60]=[O:61].[CH3:63][c:64]1[cH:65][c:66]([CH3:67])[n:68]2[n:69][c:70]([CH:71]=[O:72])[n:73][c:74]2[n:75]1.[CH:1]1([C:6]2([CH2:14][CH2:15][c:16]3[cH:17][c:18]([F:27])[c:19]([C:22]([C:23]#[N:24])([CH3:25])[CH3:26])[cH:20][cH:21]3)[O:7][C:8](=[O:13])[CH2:9][C:10](=[O:12])[CH2:11]2)[CH2:2][CH2:3][CH2:4][CH2:5]1.[Cl:28][c:29]1[cH:30][c:31]([CH2:32][CH2:33][C:34]2([CH:35]3[CH2:36][CH2:37][CH2:38][CH2:39]3)[O:40][C:41](=[O:42])[CH2:43][C:44](=[O:45])[CH2:46]2)[cH:47][c:48]([CH2:49][CH3:50])[c:51]1[O:52][CH3:53]>>[CH:1]1([C:6]2([CH2:14][CH2:15][c:16]3[cH:17][c:18]([F:27])[c:19]([C:22]([C:23]#[N:24])([CH3:25])[CH3:26])[cH:20][cH:21]3)[O:7][C:8](=[O:13])[C:9]([CH2:60][c:59]3[n:55]([CH3:54])[n:56][c:57]([CH3:62])[n:58]3)=[C:10]([OH:12])[CH2:11]2)[CH2:2][CH2:3][CH2:4][CH2:5]1

Participants

5

Reactant 4

HCID 236352265,7-Dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carbaldehydeHCID 587622136-[2-(3-Chloro-5-ethyl-4-methoxy-phenyl)-ethyl]6-cyclopentyl-dihydro-pyran-2,4-dioneHCID 587624232-{4-[2-(2-cyclopentyl-4,6-dioxotetrahydro-2H-pyran-2-yl)ethyl]-2-fluorophenyl)-2-methylpropanenitrileHCID 834786731,3-dimethyl-1H-1,2,4-triazole-5-carbaldehyde

Product 1

HCID 587642232-[4-(2-{2-Cyclopentyl-5-[(1,3-dimethyl-1H-1,2,4-triazol-5-yl)methyl]-4-hydroxy-6-oxo-3,6-dihydro-2H-pyran-2-yl}ethyl)-2-fluorophenyl]-2-methylpropanenitrile

Sources & evidence

ORD record
ord-35668b053b6f481f9b01e6c3d2364226
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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