Dimethyl Sulfoxide → Penoxsulam

HRID 168300Notes

Reaction equation

HRID 168300 reaction equation
[CH3:42][S:43]([CH3:44])=[O:45].[F:15][CH:16]([CH2:17][O:18][c:19]1[c:20]([S:29](=[O:30])(=[O:31])[Cl:32])[c:21]([C:25]([F:26])([F:27])[F:28])[cH:22][cH:23][cH:24]1)[F:33].[NH2:1][c:2]1[n:3][n:4]2[c:5]([O:13][CH3:14])[n:6][cH:7][c:8]([O:11][CH3:12])[c:9]2[n:10]1.[n:34]1[cH:35][c:36]([CH3:37])[cH:38][c:39]([CH3:40])[cH:41]1>>[NH:1]([c:2]1[n:3][n:4]2[c:5]([O:13][CH3:14])[n:6][cH:7][c:8]([O:11][CH3:12])[c:9]2[n:10]1)[S:29]([c:20]1[c:19]([O:18][CH2:17][CH:16]([F:15])[F:33])[cH:24][cH:23][cH:22][c:21]1[C:25]([F:26])([F:27])[F:28])(=[O:30])=[O:31]

Participants

5

Reactant 4

HCID 679Dimethyl SulfoxideHCID 115653,5-DimethylpyridineHCID 114468885,8-Dimethoxy-[1,2,4]triazolo[1,5-c]pyrimidin-2-amineHCID 160503082-(2,2-Difluoroethoxy)-6-(trifluoromethyl)benzene-1-sulfonyl chloride

Product 1

HCID 11784975Penoxsulam

Sources & evidence

ORD record
ord-6befc3a1fad04a1797b3a2e4b0e99a77
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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