Benzene → N-(4-(4-(Phenylmethyl)-1-piperazinyl)phenyl)acetamide

HRID 104550

Reaction equation

[CH3:21][CH2:22][N:23]([CH2:24][CH3:25])[CH2:26][CH3:27].[CH3:28][C:29]([Cl:30])=[O:31].[CH3:38][CH2:39][O:40][C:41](=[O:42])[CH3:43].[Na+:45].[OH-:44].[c:1]1([CH2:7][N:8]2[CH2:9][CH2:10][N:11]([c:14]3[cH:15][cH:16][c:17]([NH2:20])[cH:18][cH:19]3)[CH2:12][CH2:13]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1.[cH:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1>>[c:1]1([CH2:7][N:8]2[CH2:9][CH2:10][N:11]([c:14]3[cH:15][cH:16][c:17]([NH:20][C:29]([CH3:28])=[O:31])[cH:18][cH:19]3)[CH2:12][CH2:13]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

Reactant 7

HCID 241Benzene

HCID 923Sodium ion

HCID 961Hydroxide

HCID 6367Acetyl chloride

HCID 8471Triethylamine

HCID 8857Ethyl Acetate

HCID 7372594-(4-Benzylpiperazin-1-yl)aniline

Product 1

HCID 960610N-(4-(4-(Phenylmethyl)-1-piperazinyl)phenyl)acetamide

Sources & evidence

ORD record: ord-8f2f8dd371be47b18df38b793ceb9eec
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Linked notes

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