5-(2,3,4,5,6-pentamethylpyridin-1-ium-1-yl)-3H-1,3,4-thiadiazole-2-thione

Systemtic Name: 5-(2,3,4,5,6-pentamethylpyridin-1-ium-1-yl)-3H-1,3,4-thiadiazole-2-thione Openeye Name: 5-(2,3,4,5,6-pentamethylpyridin-1-ium-1-yl)-3H-1,3,4-thiadiazole-2-thione CAS Name: 5-(2,3,4,5,6-pentamethyl-1-pyridin-1-iumyl)-3H-1,3,4-thiadiazole-2-thione IUPAC Name: 5-(2,3,4,5,6-pentamethylpyridin-1-ium-1-yl)-3H-1,3,4-thiadiazole-2-thione Traditional Name: 5-(2,3,4,5,6-pentamethylpyridin-1-ium-1-yl)-3H-1,3,4-thiadiazole-2-thione Formula: C12H16N3S2+ MolecularWeight: 266.40554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=[N+](C(=C1C)C)C2=NNC(=S)S2)C)C

Isomeric SMILES

CC1=C(C(=[N+](C(=C1C)C)C2=NNC(=S)S2)C)C

InChI

InChI=1S/C12H15N3S2/c1-6-7(2)9(4)15(10(5)8(6)3)11-13-14-12(16)17-11/h1-5H3/p+1