4-(trifluoromethylsulfanyl)-1,2-dihydropyrazol-3-one

Systemtic Name: 4-(trifluoromethylsulfanyl)-1,2-dihydropyrazol-3-one Openeye Name: 4-(trifluoromethylsulfanyl)-1,2-dihydropyrazol-3-one CAS Name: 4-(trifluoromethylthio)-1,2-dihydropyrazol-3-one IUPAC Name: 4-(trifluoromethylsulfanyl)-1,2-dihydropyrazol-3-one Traditional Name: 4-(trifluoromethylthio)-3-pyrazolin-3-one Formula: C4H3F3N2OS MolecularWeight: 184.13963

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=O)NN1)SC(F)(F)F

Isomeric SMILES

C1=C(C(=O)NN1)SC(F)(F)F

InChI

InChI=1S/C4H3F3N2OS/c5-4(6,7)11-2-1-8-9-3(2)10/h1H,(H2,8,9,10)