Dimethyl Sulfoxide → Tert-butyl 4-(3-chloro-2-cyanophenyl)piperazine-1-carboxylate

HRID 89287

Reaction equation

HRID 89287 reaction equation
[C:1](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[N:8]1[CH2:9][CH2:10][NH:11][CH2:12][CH2:13]1.[C:24](=[O:25])([O-:26])[O-:27].[CH3:30][S:31]([CH3:32])=[O:33].[CH3:34][CH2:35][O:36][CH2:37][CH3:38].[F:14][c:15]1[c:16]([C:17]#[N:18])[c:19]([Cl:23])[cH:20][cH:21][cH:22]1.[K+:28].[K+:29]>>[C:1](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[N:8]1[CH2:9][CH2:10][N:11]([c:15]2[c:16]([C:17]#[N:18])[c:19]([Cl:23])[cH:20][cH:21][cH:22]2)[CH2:12][CH2:13]1

Participants

7

Reactant 6

HCID 679Dimethyl SulfoxideHCID 813Potassium Cation2×HCID 3283Diethyl EtherHCID 19660Carbonate IonHCID 695872-Chloro-6-fluorobenzonitrileHCID 143452tert-Butyl piperazine-1-carboxylate

Product 1

HCID 17952290Tert-butyl 4-(3-chloro-2-cyanophenyl)piperazine-1-carboxylate

Sources & evidence

ORD record
ord-b8a714bfa16642729e1dac9489fbc87f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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