1-methyl-3-[(1-methyl-2-sulfanyl-pyridin-1-ium-3-yl)methyl]pyridin-1-ium-2-thiol

Systemtic Name: 1-methyl-3-[(1-methyl-2-sulfanyl-pyridin-1-ium-3-yl)methyl]pyridin-1-ium-2-thiol Openeye Name: 1-methyl-3-[(1-methyl-2-sulfanyl-pyridin-1-ium-3-yl)methyl]pyridin-1-ium-2-thiol CAS Name: 3-[(2-mercapto-1-methyl-3-pyridin-1-iumyl)methyl]-1-methyl-2-pyridin-1-iumthiol IUPAC Name: 1-methyl-3-[(1-methyl-2-sulfanylpyridin-1-ium-3-yl)methyl]pyridin-1-ium-2-thiol Traditional Name: 3-[(2-mercapto-1-methyl-pyridin-1-ium-3-yl)methyl]-1-methyl-pyridin-1-ium-2-thiol Formula: C13H16N2S2+2 MolecularWeight: 264.40954

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC(=C1S)CC2=C([N+](=CC=C2)C)S

Isomeric SMILES

C[N+]1=CC=CC(=C1S)CC2=C([N+](=CC=C2)C)S

InChI

InChI=1S/C13H14N2S2/c1-14-7-3-5-10(12(14)16)9-11-6-4-8-15(2)13(11)17/h3-8H,9H2,1-2H3/p+2