2-[1-azanyl-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethylidene]propanedinitrile

Systemtic Name: 2-[1-azanyl-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethylidene]propanedinitrile Openeye Name: 2-[1-amino-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-ethylidene]propanedinitrile CAS Name: 2-[1-amino-2-[(1-oxido-2-pyridin-1-iumyl)thio]ethylidene]propanedinitrile IUPAC Name: 2-[1-amino-2-(1-oxidopyridin-1-ium-2-yl)sulfanylethylidene]propanedinitrile Traditional Name: 2-[1-amino-2-[(1-oxidopyridin-1-ium-2-yl)thio]ethylidene]malononitrile Formula: C10H8N4OS MolecularWeight: 232.26172

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C(=C1)SCC(=C(C#N)C#N)N)[O-]

Isomeric SMILES

C1=CC=[N+](C(=C1)SCC(=C(C#N)C#N)N)[O-]

InChI

InChI=1S/C10H8N4OS/c11-5-8(6-12)9(13)7-16-10-3-1-2-4-14(10)15/h1-4H,7,13H2