Pyridine → 4-Nitrobenzyl thioacetate

HRID 2335639Notes

Reaction equation

HRID 2335639 reaction equation
[C:37]([CH3:38])(=[S:39])[OH:40].[CH2:41]1[O:42][CH2:43][CH2:44][CH2:45]1.[N+:12]([c:13]1[cH:14][c:15]([N+:16]([O-:17])=[O:18])[cH:19][cH:20][c:21]1[CH2:22][SH:23])([O-:24])=[O:25].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([CH2:8][SH:9])[cH:10][cH:11]1.[N+:26]([c:27]1[cH:28][cH:29][c:30]([CH2:31][Cl:32])[cH:33][cH:34]1)([O-:35])=[O:36].[cH:46]1[cH:47][cH:48][n:49][cH:50][cH:51]1>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([CH2:8][O:40][C:37]([CH3:38])=[S:39])[cH:10][cH:11]1

Participants

7

Reactant 6

HCID 1049PyridineHCID 74824-Nitrobenzyl chlorideHCID 8028TetrahydrofuranHCID 1936194-Nitrobenzyl mercaptanHCID 107038212,4-Dinitrobenzyl mercaptanHCID 178418634HCID 178418634, compound

Product 1

HCID 197105064-Nitrobenzyl thioacetate

Sources & evidence

ORD record
ord-e542348fc54c4f7787ea57350ba9187a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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