Toluene → HCID 57192219, compound

HRID 1127590Notes

Reaction equation

HRID 1127590 reaction equation
[CH3:29][c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1.[F:1][c:2]1[cH:3][c:4]([S:8][CH:9]([CH2:10][CH:11]([CH2:12][C:13]([CH3:14])=[O:15])[OH:16])[CH3:17])[cH:5][cH:6][cH:7]1.[c:18]1([CH3:19])[cH:20][cH:21][c:22]([S:23]([OH:24])(=[O:25])=[O:26])[cH:27][cH:28]1>>[F:1][c:2]1[cH:3][c:4]([S:8][CH:9]([CH2:10][CH:11]=[CH:12][C:13]([CH3:14])=[O:15])[CH3:17])[cH:5][cH:6][cH:7]1

Participants

4

Sources & evidence

ORD record
ord-5f952d0d742947d98d21cd1551de1be5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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