Benzene → HCID 20325616, compound

HRID 1227817Notes

Reaction equation

HRID 1227817 reaction equation
[CH2:1]([CH:2]([CH3:3])[CH3:4])[CH:5]1[CH2:6][C:7](=[O:12])[CH2:8][C:9](=[O:11])[CH2:10]1.[c:13]1([CH3:25])[cH:14][cH:15][c:16]([S:19](=[O:20])(=[O:21])[N:22]=[C:23]=[O:24])[cH:17][cH:18]1.[cH:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1>>[CH2:1]([CH:2]([CH3:3])[CH3:4])[CH:5]1[CH2:6][C:7](=[O:12])[CH:8]([C:23]([NH:22][S:19]([c:16]2[cH:15][cH:14][c:13]([CH3:25])[cH:18][cH:17]2)(=[O:20])=[O:21])=[O:24])[C:9](=[O:11])[CH2:10]1

Participants

4

Reactant 3

HCID 241BenzeneHCID 77703p-Toluenesulfonyl isocyanateHCID 27366735-Isobutylcyclohexane-1,3-dione

Product 1

HCID 20325616HCID 20325616, compound

Sources & evidence

ORD record
ord-27e5f245516e40739e072276ea6cf5d3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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