Dimethyl Sulfoxide → Ethyl 4-(4-cyclobutylpiperazin-1-yl)benzoate

HRID 2320506Notes

Reaction equation

HRID 2320506 reaction equation
[C:23](=[O:24])([O-:25])[O-:26].[CH3:29][S:30]([CH3:31])=[O:32].[CH:13]1([N:17]2[CH2:18][CH2:19][NH:20][CH2:21][CH2:22]2)[CH2:14][CH2:15][CH2:16]1.[F:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[O:8][CH2:9][CH3:10])[cH:11][cH:12]1.[K+:27].[K+:28]>>[c:2]1([N:20]2[CH2:19][CH2:18][N:17]([CH:13]3[CH2:14][CH2:15][CH2:16]3)[CH2:22][CH2:21]2)[cH:3][cH:4][c:5]([C:6](=[O:7])[O:8][CH2:9][CH3:10])[cH:11][cH:12]1

Participants

6

Reactant 5

HCID 679Dimethyl SulfoxideHCID 813Potassium Cation2×HCID 19660Carbonate IonHCID 67976Benzoic acid, 4-fluoro-, ethyl esterHCID 47386021-Cyclobutylpiperazine

Product 1

HCID 57440408Ethyl 4-(4-cyclobutylpiperazin-1-yl)benzoate

Sources & evidence

ORD record
ord-d924b210e630427d8b15dd94086c0d73
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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