3-methyl-4-phenyl-1,2,3-thiadiazol-3-ium tetrafluoroborate

Systemtic Name: 3-methyl-4-phenyl-1,2,3-thiadiazol-3-ium tetrafluoroborate Openeye Name: 3-methyl-4-phenyl-thiadiazol-3-ium tetrafluoroborate CAS Name: 3-methyl-4-phenylthiadiazol-3-ium tetrafluoroborate IUPAC Name: 3-methyl-4-phenylthiadiazol-3-ium tetrafluoroborate Traditional Name: 3-methyl-4-phenyl-thiadiazol-3-ium tetrafluoroborate Formula: C9H9BF4N2S MolecularWeight: 264.050773

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.C[N+]1=NSC=C1C2=CC=CC=C2

Isomeric SMILES

[B-](F)(F)(F)F.C[N+]1=NSC=C1C2=CC=CC=C2

InChI

InChI=1S/C9H9N2S.BF4/c1-11-9(7-12-10-11)8-5-3-2-4-6-8;2-1(3,4)5/h2-7H,1H3;/q+1;-1