5-[3,4,4-tris(fluoranyl)but-3-enylsulfanyl]-1H-1,2,4-triazole

Systemtic Name: 5-[3,4,4-tris(fluoranyl)but-3-enylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-(3,4,4-trifluorobut-3-enylsulfanyl)-1H-1,2,4-triazole CAS Name: 5-(3,4,4-trifluorobut-3-enylthio)-1H-1,2,4-triazole IUPAC Name: 5-(3,4,4-trifluorobut-3-enylsulfanyl)-1H-1,2,4-triazole Traditional Name: 5-(3,4,4-trifluorobut-3-enylthio)-1H-1,2,4-triazole Formula: C6H6F3N3S MolecularWeight: 209.19215

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Descriptors Computed from Structure

Canonical SMILES:

C1=NNC(=N1)SCCC(=C(F)F)F

Isomeric SMILES

C1=NNC(=N1)SCCC(=C(F)F)F

InChI

InChI=1S/C6H6F3N3S/c7-4(5(8)9)1-2-13-6-10-3-11-12-6/h3H,1-2H2,(H,10,11,12)