Potassium Cation → HCID 66705452, compound

HRID 1238150Notes

Reaction equation

HRID 1238150 reaction equation
[C:40](#[N:41])[CH2:42][P:43](=[O:44])([O:45][CH2:46][CH3:47])[O:48][CH2:49][CH3:50].[CH2:57]1[O:58][CH2:59][CH2:60][CH2:61]1.[CH3:51][C:52]([CH3:53])([O-:54])[CH3:55].[F:1][c:2]1[n:3][c:4]([NH:30][CH2:31][c:32]2[cH:33][cH:34][c:35]([O:38][CH3:39])[cH:36][cH:37]2)[cH:5][c:6]([CH2:8][n:9]2[c:10](=[O:29])[nH:11][c:12](=[O:28])[c:13]([CH:25]([CH3:26])[CH3:27])[c:14]2[O:15][c:16]2[cH:17][c:18]([CH:19]=[O:20])[cH:21][c:22]([CH3:24])[cH:23]2)[cH:7]1.[K+:56]>>[F:1][c:2]1[n:3][c:4]([NH:30][CH2:31][c:32]2[cH:33][cH:34][c:35]([O:38][CH3:39])[cH:36][cH:37]2)[cH:5][c:6]([CH2:8][n:9]2[c:10](=[O:29])[nH:11][c:12](=[O:28])[c:13]([CH:25]([CH3:26])[CH3:27])[c:14]2[O:15][c:16]2[cH:17][c:18]([CH:19]=[CH:42][C:40]#[N:41])[cH:21][c:22]([CH3:24])[cH:23]2)[cH:7]1

Participants

6

Reactant 5

HCID 813Potassium CationHCID 8028TetrahydrofuranHCID 75676Diethyl (cyanomethyl)phosphonateHCID 45749132-Methylpropan-2-olateHCID 591848683-{3-[2-Fluoro-6-(4-methoxy-benzylamino)-pyridin-4-ylmethyl]-5-isopropyl-2,6-dioxo-1,2,3,6-tetrahydro-pyrimidin-4-yloxy}-5-methyl-benzaldehyde

Product 1

HCID 66705452HCID 66705452, compound

Sources & evidence

ORD record
ord-0f79b2f0be024aac91dbe3e32f3de942
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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