(3,5-dicyano-6-pyridin-1-ium-1-yl-pyrazin-2-yl)carbamodithioic acid chloride

Systemtic Name: (3,5-dicyano-6-pyridin-1-ium-1-yl-pyrazin-2-yl)carbamodithioic acid chloride Openeye Name: (3,5-dicyano-6-pyridin-1-ium-1-yl-pyrazin-2-yl)carbamodithioic acid chloride CAS Name: [3,5-dicyano-6-(1-pyridin-1-iumyl)-2-pyrazinyl]carbamodithioic acid chloride IUPAC Name: (3,5-dicyano-6-pyridin-1-ium-1-ylpyrazin-2-yl)carbamodithioic acid chloride Traditional Name: (3,5-dicyano-6-pyridin-1-ium-1-yl-pyrazin-2-yl)carbamodithioic acid chloride Formula: C12H7ClN6S2 MolecularWeight: 334.80718

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)C2=C(N=C(C(=N2)NC(=S)S)C#N)C#N.[Cl-]

Isomeric SMILES

C1=CC=[N+](C=C1)C2=C(N=C(C(=N2)NC(=S)S)C#N)C#N.[Cl-]

InChI

InChI=1S/C12H6N6S2.ClH/c13-6-8-10(17-12(19)20)16-11(9(7-14)15-8)18-4-2-1-3-5-18;/h1-5H,(H-,16,17,19,20);1H