5-(2,4,6-trimethylpyridin-1-ium-1-yl)-1,3,4-thiadiazole-2-sulfonamide tetrafluoroborate

Systemtic Name: 5-(2,4,6-trimethylpyridin-1-ium-1-yl)-1,3,4-thiadiazole-2-sulfonamide tetrafluoroborate Openeye Name: 5-(2,4,6-trimethylpyridin-1-ium-1-yl)-1,3,4-thiadiazole-2-sulfonamide tetrafluoroborate CAS Name: 5-(2,4,6-trimethyl-1-pyridin-1-iumyl)-1,3,4-thiadiazole-2-sulfonamide tetrafluoroborate IUPAC Name: 5-(2,4,6-trimethylpyridin-1-ium-1-yl)-1,3,4-thiadiazole-2-sulfonamide tetrafluoroborate Traditional Name: 5-(2,4,6-trimethylpyridin-1-ium-1-yl)-1,3,4-thiadiazole-2-sulfonamide tetrafluoroborate Formula: C10H13BF4N4O2S2 MolecularWeight: 372.170433

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC1=CC(=[N+](C(=C1)C)C2=NN=C(S2)S(=O)(=O)N)C

Isomeric SMILES

[B-](F)(F)(F)F.CC1=CC(=[N+](C(=C1)C)C2=NN=C(S2)S(=O)(=O)N)C

InChI

InChI=1S/C10H13N4O2S2.BF4/c1-6-4-7(2)14(8(3)5-6)9-12-13-10(17-9)18(11,15)16;2-1(3,4)5/h4-5H,1-3H3,(H2,11,15,16);/q+1;-1