Ethanol → 3-[4-(4-Chlorobenzyl)homopiperazin-1-yl]-propanethiol

HRID 299730

Reaction equation

HRID 299730 reaction equation
[CH3:24][CH2:25][OH:26].[Cl:5][c:6]1[cH:7][cH:8][c:9]([CH2:10][N:11]2[CH2:12][CH2:13][N:14]([CH2:18][CH2:19][CH2:20][Cl:21])[CH2:15][CH2:16][CH2:17]2)[cH:22][cH:23]1.[NH2:1][C:2]([NH2:3])=[S:4].[Na+:28].[OH-:27].[OH2:29]>>[CH2:2]([SH:4])[CH2:19][CH2:18][N:14]1[CH2:13][CH2:12][N:11]([CH2:10][c:9]2[cH:8][cH:7][c:6]([Cl:5])[cH:23][cH:22]2)[CH2:17][CH2:16][CH2:15]1

Participants

7

Reactant 6

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 2723790ThioureaHCID 201531881-(4-Chlorobenzyl)-4-(3-chloropropyl)homopiperazine

Product 1

HCID 201531743-[4-(4-Chlorobenzyl)homopiperazin-1-yl]-propanethiol

Sources & evidence

ORD record
ord-2e0e2f400eb34205ade8a13f2a2d53be
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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