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

Systemtic Name: 5-chloranyl-3-methyl-4-phenyl-1,2,3-thiadiazol-3-ium tetrafluoroborate Openeye Name: 5-chloro-3-methyl-4-phenyl-thiadiazol-3-ium tetrafluoroborate CAS Name: 5-chloro-3-methyl-4-phenylthiadiazol-3-ium tetrafluoroborate IUPAC Name: 5-chloro-3-methyl-4-phenylthiadiazol-3-ium tetrafluoroborate Traditional Name: 5-chloro-3-methyl-4-phenyl-thiadiazol-3-ium tetrafluoroborate Formula: C9H8BClF4N2S MolecularWeight: 298.495833

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8ClN2S.BF4/c1-12-8(9(10)13-11-12)7-5-3-2-4-6-7;2-1(3,4)5/h2-6H,1H3;/q+1;-1