4-(4-fluorophenyl)-2-methyl-5-(4-methylsulfanylphenyl)-1,2-oxazol-2-ium tetrafluoroborate

Systemtic Name: 4-(4-fluorophenyl)-2-methyl-5-(4-methylsulfanylphenyl)-1,2-oxazol-2-ium tetrafluoroborate Openeye Name: 4-(4-fluorophenyl)-2-methyl-5-(4-methylsulfanylphenyl)isoxazol-2-ium tetrafluoroborate CAS Name: 4-(4-fluorophenyl)-2-methyl-5-[4-(methylthio)phenyl]isoxazol-2-ium tetrafluoroborate IUPAC Name: 4-(4-fluorophenyl)-2-methyl-5-(4-methylsulfanylphenyl)-1,2-oxazol-2-ium tetrafluoroborate Traditional Name: 4-(4-fluorophenyl)-2-methyl-5-[4-(methylthio)phenyl]isoxazol-2-ium tetrafluoroborate Formula: C17H15BF5NOS MolecularWeight: 387.175116

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.C[N+]1=CC(=C(O1)C2=CC=C(C=C2)SC)C3=CC=C(C=C3)F

Isomeric SMILES

[B-](F)(F)(F)F.C[N+]1=CC(=C(O1)C2=CC=C(C=C2)SC)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H15FNOS.BF4/c1-19-11-16(12-3-7-14(18)8-4-12)17(20-19)13-5-9-15(21-2)10-6-13;2-1(3,4)5/h3-11H,1-2H3;/q+1;-1