Water → 1-(2,6-Dichloro-4-trifluoromethylphenyl)-5-methoxymethylideneamino-3-(1,2,4-oxadiazol-3-yl)-4-trifluoromethylsulfonylpyrazole

HRID 298435Notes

Reaction equation

HRID 298435 reaction equation
[CH:43]([O:44][CH3:45])([O:46][CH3:47])[O:48][CH3:49].[NH2:1][c:2]1[c:3]([S:24](=[O:25])(=[O:26])[C:27]([F:28])([F:29])[F:30])[c:4](-[c:19]2[n:20][o:21][cH:22][n:23]2)[n:5][n:6]1-[c:7]1[c:8]([Cl:18])[cH:9][c:10]([C:14]([F:15])([F:16])[F:17])[cH:11][c:12]1[Cl:13].[OH2:31].[c:32]1([CH3:33])[cH:34][cH:35][c:36]([S:37]([OH:38])(=[O:39])=[O:40])[cH:41][cH:42]1>>[N:1]([c:2]1[c:3]([S:24](=[O:25])(=[O:26])[C:27]([F:28])([F:29])[F:30])[c:4](-[c:19]2[n:20][o:21][cH:22][n:23]2)[n:5][n:6]1-[c:7]1[c:8]([Cl:18])[cH:9][c:10]([C:14]([F:15])([F:16])[F:17])[cH:11][c:12]1[Cl:13])=[CH:43][O:44][CH3:45]

Participants

5

Reactant 4

HCID 962WaterHCID 6101p-Toluenesulfonic acidHCID 9005Trimethyl orthoformateHCID 183547765-Amino-1-(2,6-dichloro-4-trifluoromethylphenyl)-3-(1,2,4-oxadiazol-3-yl)-4-trifluoromethylsulfonylpyrazole

Product 1

HCID 734317151-(2,6-Dichloro-4-trifluoromethylphenyl)-5-methoxymethylideneamino-3-(1,2,4-oxadiazol-3-yl)-4-trifluoromethylsulfonylpyrazole

Sources & evidence

ORD record
ord-e9b75176a8974d5686ef3943f67870dc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

Loading…