6-[(5-carboxylato-3-cyano-6-oxidanylidene-1H-pyridin-2-yl)disulfanyl]-5-cyano-2-oxidanidyl-pyridine-3-carboxylate

Systemtic Name: 6-[(5-carboxylato-3-cyano-6-oxidanylidene-1H-pyridin-2-yl)disulfanyl]-5-cyano-2-oxidanidyl-pyridine-3-carboxylate Openeye Name: 6-[(5-carboxylato-3-cyano-6-oxo-1H-pyridin-2-yl)disulfanyl]-5-cyano-2-oxido-pyridine-3-carboxylate CAS Name: 6-[(5-carboxylato-3-cyano-6-oxo-1H-pyridin-2-yl)disulfanyl]-5-cyano-2-oxido-3-pyridinecarboxylate IUPAC Name: 6-[(5-carboxylato-3-cyano-6-oxo-1H-pyridin-2-yl)disulfanyl]-5-cyano-2-oxidopyridine-3-carboxylate Traditional Name: 6-[(5-carboxylato-3-cyano-6-keto-1H-pyridin-2-yl)disulfanyl]-5-cyano-2-oxido-nicotinate Formula: C14H3N4O6S2-3 MolecularWeight: 387.32682

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=NC(=C1C(=O)[O-])[O-])SSC2=C(C=C(C(=O)N2)C(=O)[O-])C#N)C#N

Isomeric SMILES

C1=C(C(=NC(=C1C(=O)[O-])[O-])SSC2=C(C=C(C(=O)N2)C(=O)[O-])C#N)C#N

InChI

InChI=1S/C14H6N4O6S2/c15-3-5-1-7(13(21)22)9(19)17-11(5)25-26-12-6(4-16)2-8(14(23)24)10(20)18-12/h1-2H,(H,17,19)(H,18,20)(H,21,22)(H,23,24)/p-3