3-cyano-2-(2-cyanoethylsulfanyl)-7-oxidanylidene-4H-thieno[3,2-b]pyridin-5-olate

Systemtic Name: 3-cyano-2-(2-cyanoethylsulfanyl)-7-oxidanylidene-4H-thieno[3,2-b]pyridin-5-olate Openeye Name: 3-cyano-2-(2-cyanoethylsulfanyl)-7-oxo-4H-thieno[3,2-b]pyridin-5-olate CAS Name: 3-cyano-2-(2-cyanoethylthio)-7-oxo-4H-thieno[3,2-b]pyridin-5-olate IUPAC Name: 3-cyano-2-(2-cyanoethylsulfanyl)-7-oxo-4H-thieno[3,2-b]pyridin-5-olate Traditional Name: 3-cyano-2-(2-cyanoethylthio)-7-keto-4H-thieno[3,2-b]pyridin-5-olate Formula: C11H6N3O2S2- MolecularWeight: 276.31424

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC2=C(C1=O)SC(=C2C#N)SCCC#N)[O-]

Isomeric SMILES

C1=C(NC2=C(C1=O)SC(=C2C#N)SCCC#N)[O-]

InChI

InChI=1S/C11H7N3O2S2/c12-2-1-3-17-11-6(5-13)9-10(18-11)7(15)4-8(16)14-9/h4H,1,3H2,(H2,14,15,16)/p-1