ethyl 3-azanyl-5-cyano-4-methylsulfanyl-6-oxidanylidene-7H-thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: ethyl 3-azanyl-5-cyano-4-methylsulfanyl-6-oxidanylidene-7H-thieno[2,3-b]pyridine-2-carboxylate Openeye Name: ethyl 3-amino-5-cyano-4-methylsulfanyl-6-oxo-7H-thieno[2,3-b]pyridine-2-carboxylate CAS Name: 3-amino-5-cyano-4-(methylthio)-6-oxo-7H-thieno[2,3-b]pyridine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-amino-5-cyano-4-methylsulfanyl-6-oxo-7H-thieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3-amino-5-cyano-6-keto-4-(methylthio)-7H-thieno[2,3-b]pyridine-2-carboxylic acid ethyl ester Formula: C12H11N3O3S2 MolecularWeight: 309.36404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)NC(=O)C(=C2SC)C#N)N

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)NC(=O)C(=C2SC)C#N)N

InChI

InChI=1S/C12H11N3O3S2/c1-3-18-12(17)9-7(14)6-8(19-2)5(4-13)10(16)15-11(6)20-9/h3,14H2,1-2H3,(H,15,16)