Dimethyl Sulfoxide → 4-[1-(2-Methyl-8-nitro-1-oxo-1,2,3,4-tetrahydro-isoquinolin-5-yl)-piperidin-4-yl]-piperazine-1-carboxylic acid tert-butyl ester

HRID 811293Notes

Reaction equation

HRID 811293 reaction equation
[C:17]([CH3:18])([CH3:19])([CH3:20])[O:21][C:22](=[O:23])[N:24]1[CH2:25][CH2:26][N:27]([CH:30]2[CH2:31][CH2:32][NH:33][CH2:34][CH2:35]2)[CH2:28][CH2:29]1.[CH3:42][S:43]([CH3:44])=[O:45].[F:1][c:2]1[c:3]2[c:8]([c:9]([N+:12](=[O:13])[O-:14])[cH:10][cH:11]1)[C:7](=[O:15])[N:6]([CH3:16])[CH2:5][CH2:4]2.[K+:36].[K+:37].[O-:38][C:39]([O-:40])=[O:41]>>[c:2]1([N:33]2[CH2:32][CH2:31][CH:30]([N:27]3[CH2:26][CH2:25][N:24]([C:22]([O:21][C:17]([CH3:18])([CH3:19])[CH3:20])=[O:23])[CH2:29][CH2:28]3)[CH2:35][CH2:34]2)[c:3]2[c:8]([c:9]([N+:12](=[O:13])[O-:14])[cH:10][cH:11]1)[C:7](=[O:15])[N:6]([CH3:16])[CH2:5][CH2:4]2

Participants

6

Reactant 5

HCID 679Dimethyl SulfoxideHCID 813Potassium Cation2×HCID 19660Carbonate IonHCID 17750356tert-Butyl 4-(piperidin-4-yl)piperazine-1-carboxylateHCID 598491765-fluoro-2-methyl-8-nitro-3,4-dihydro-2H-isoquinolin-1-one

Product 1

HCID 598491704-[1-(2-Methyl-8-nitro-1-oxo-1,2,3,4-tetrahydro-isoquinolin-5-yl)-piperidin-4-yl]-piperazine-1-carboxylic acid tert-butyl ester

Sources & evidence

ORD record
ord-0c6b9752a68842cd8d7967e3c389a7fa
Source dataset
Test data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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