Benzene → HCID 178475760, compound

HRID 292060Notes

Reaction equation

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

Participants

Reactant 4

HCID 241Benzene

HCID 6375Nitromethane

HCID 5850584-Thiobenzonitrile

HCID 14374025(3S,4S,5R,6S)-4,5-bis(acetyloxy)-6-bromothian-3-yl acetate

Product 1

HCID 178475760HCID 178475760, compound

Sources & evidence

ORD record: ord-ede0d5cdc8844e5a888d57965d81dd36
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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