Potassium Cation → 4-(2-benzylsulfonyl-4-cyanophenyl)-3,6-dimethyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-4H-pyrimidine-5-carbonitrile

HRID 178210Notes

Reaction equation

HRID 178210 reaction equation
[Br:34][CH2:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1.[C:1](#[N:2])[c:3]1[cH:4][cH:5][c:6]([CH:12]2[N:13]([CH3:32])[C:14](=[O:31])[N:15]([c:21]3[cH:22][c:23]([C:27]([F:28])([F:29])[F:30])[cH:24][cH:25][cH:26]3)[C:16]([CH3:20])=[C:17]2[C:18]#[N:19])[c:7]([S:9](=[O:10])[O-:11])[cH:8]1.[I-:43].[K+:42].[Na+:33].[O:44]=[CH:45][N:46]([CH3:47])[CH3:48]>>[C:1](#[N:2])[c:3]1[cH:4][cH:5][c:6]([CH:12]2[N:13]([CH3:32])[C:14](=[O:31])[N:15]([c:21]3[cH:22][c:23]([C:27]([F:28])([F:29])[F:30])[cH:24][cH:25][cH:26]3)[C:16]([CH3:20])=[C:17]2[C:18]#[N:19])[c:7]([S:9](=[O:10])(=[O:11])[CH2:35][c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[cH:8]1

Participants

7

Reactant 6

HCID 813Potassium CationHCID 923Sodium ionHCID 6228DimethylformamideHCID 7498Benzyl BromideHCID 30165Iodide IonHCID 178428463HCID 178428463, compound

Product 1

HCID 687592544-(2-benzylsulfonyl-4-cyanophenyl)-3,6-dimethyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-4H-pyrimidine-5-carbonitrile

Sources & evidence

ORD record
ord-d2006e48232741dab183f05e4adab261
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

Loading…