Toluene → HCID 69448731, compound

HRID 319219Notes

Reaction equation

HRID 319219 reaction equation
[CH3:19][C:20](=[O:21])[O:22][C:23](=[O:24])[CH3:25].[CH3:26][C:27]#[N:28].[CH3:29][c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1.[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][n:10]3[c:11]([S:17][CH3:18])[n:12][cH:13][cH:14][c:15]3[cH:16]2)[cH:6][cH:7]1>>[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][n:10]3[c:11]([S:17][CH3:18])[n:12][cH:13][cH:14][c:15]3[c:16]2[C:20]([CH3:19])=[O:21])[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 1140TolueneHCID 6342AcetonitrileHCID 7918Acetic AnhydrideHCID 17956316HCID 17956316, compound

Product 1

HCID 69448731HCID 69448731, compound

Sources & evidence

ORD record
ord-0390eeb334664df991b2af6893f00406
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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