Acetonitrile → Ethyl 4-[2-[4-(4-pyridyl)piperazin-1-yl]acetyl]phenoxyacetate

HRID 692982

Reaction equation

HRID 692982 reaction equation
[Br:1][CH2:2][C:3](=[O:4])[c:5]1[cH:6][cH:7][c:8]([O:9][CH2:10][C:11](=[O:12])[O:13][CH2:14][CH3:15])[cH:16][cH:17]1.[CH3:30][C:31]#[N:32].[n:18]1[cH:19][cH:20][c:21]([N:24]2[CH2:25][CH2:26][NH:27][CH2:28][CH2:29]2)[cH:22][cH:23]1>>[CH2:2]([C:3](=[O:4])[c:5]1[cH:6][cH:7][c:8]([O:9][CH2:10][C:11](=[O:12])[O:13][CH2:14][CH3:15])[cH:16][cH:17]1)[N:27]1[CH2:26][CH2:25][N:24]([c:21]2[cH:20][cH:19][n:18][cH:23][cH:22]2)[CH2:29][CH2:28]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 705171-(4-Pyridyl)piperazineHCID 18408936Ethyl 2-[4-(2-bromoacetyl)phenoxy]acetate

Product 1

HCID 18918266Ethyl 4-[2-[4-(4-pyridyl)piperazin-1-yl]acetyl]phenoxyacetate

Sources & evidence

ORD record
ord-9d5a4dd69acb4292b9c0de1c94bbec9a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Linked notes

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