Toluene → Sulfentrazone

HRID 1551551Notes

Reaction equation

HRID 1551551 reaction equation
[CH3:20][S:21]([Cl:22])(=[O:23])=[O:24].[CH3:25][c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1.[NH2:1][c:2]1[c:3]([Cl:19])[cH:4][c:5]([Cl:18])[c:6](-[n:8]2[n:9][c:10]([CH3:17])[n:11]([CH:14]([F:15])[F:16])[c:12]2=[O:13])[cH:7]1>>[NH:1]([c:2]1[c:3]([Cl:19])[cH:4][c:5]([Cl:18])[c:6](-[n:8]2[n:9][c:10]([CH3:17])[n:11]([CH:14]([F:15])[F:16])[c:12]2=[O:13])[cH:7]1)[S:21]([CH3:20])(=[O:23])=[O:24]

Participants

4

Reactant 3

HCID 1140TolueneHCID 31297Methanesulfonyl chlorideHCID 110559662-(5-Amino-2,4-dichlorophenyl)-4-(difluoromethyl)-2,4-dihydro-5-methyl-3H-1,2,4-triazol-3-one

Product 1

HCID 86369Sulfentrazone

Sources & evidence

ORD record
ord-0413a995e75540778b75f6c49bf11b10
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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