Potassium Cation → 6-(6-ethoxy-2-methyl-5-nitro-pyrimidin-4-yl)-5,6,7,8-tetrahydro-4H-thieno[2,3-d]azepine

HRID 2130722Notes

Reaction equation

HRID 2130722 reaction equation
[C:25](=[O:26])([O-:27])[O-:28].[CH2:22]([CH3:23])[Br:24].[CH3:1][c:2]1[n:3][c:4]([N:12]2[CH2:13][CH2:14][c:15]3[c:16]([cH:19][cH:20][s:21]3)[CH2:17][CH2:18]2)[c:5]([N+:9](=[O:10])[O-:11])[c:6](=[O:8])[nH:7]1.[CH3:31][N:32]([CH3:33])[CH:34]=[O:35].[K+:29].[K+:30]>>[CH3:1][c:2]1[n:3][c:4]([N:12]2[CH2:13][CH2:14][c:15]3[c:16]([cH:19][cH:20][s:21]3)[CH2:17][CH2:18]2)[c:5]([N+:9](=[O:10])[O-:11])[c:6]([O:8][CH2:22][CH3:23])[n:7]1

Participants

6

Reactant 5

HCID 813Potassium Cation2×HCID 6228DimethylformamideHCID 6332Ethyl BromideHCID 19660Carbonate IonHCID 1356711622-Methyl-5-nitro-6-(4,5,7,8-tetrahydro-thieno[2,3-d]azepin-6-yl)-3H-pyrimidin-4-one

Product 1

HCID 226207656-(6-ethoxy-2-methyl-5-nitro-pyrimidin-4-yl)-5,6,7,8-tetrahydro-4H-thieno[2,3-d]azepine

Sources & evidence

ORD record
ord-c2f703f348214d77876416845f9f5097
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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