Potassium Cation → 2-(benzimidazol-1-yl)-N-(3-methyloxan-4-yl)-5-nitropyrimidin-4-amine

HRID 1558776Notes

Reaction equation

HRID 1558776 reaction equation
[C:19](=[O:20])([O-:21])[O-:22].[CH3:34][C:35]#[N:36].[CH3:37][CH2:38][O:39][C:40]([CH3:41])=[O:42].[Cl:1][c:2]1[n:3][cH:4][c:5]([N+:16](=[O:17])[O-:18])[c:6]([NH:8][CH:9]2[CH:10]([CH3:15])[CH2:11][O:12][CH2:13][CH2:14]2)[n:7]1.[K+:23].[K+:24].[n:25]1[cH:26][nH:27][c:28]2[c:29]1[cH:30][cH:31][cH:32][cH:33]2>>[c:2]1(-[n:25]2[cH:26][n:27][c:28]3[c:29]2[cH:30][cH:31][cH:32][cH:33]3)[n:3][cH:4][c:5]([N+:16](=[O:17])[O-:18])[c:6]([NH:8][CH:9]2[CH:10]([CH3:15])[CH2:11][O:12][CH2:13][CH2:14]2)[n:7]1

Participants

7

Reactant 6

HCID 813Potassium Cation2×HCID 5798BenzimidazoleHCID 6342AcetonitrileHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 59726943HCID 59726943, compound

Product 1

HCID 597269362-(benzimidazol-1-yl)-N-(3-methyloxan-4-yl)-5-nitropyrimidin-4-amine

Sources & evidence

ORD record
ord-ecd305d485034172bc607ccba95b3f2a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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