ethyl N-[2-[(3-cyano-5-oxidanyl-7-oxidanylidene-4H-thieno[3,2-b]pyridin-2-yl)sulfanyl]ethanoyl]carbamate

Systemtic Name: ethyl N-[2-[(3-cyano-5-oxidanyl-7-oxidanylidene-4H-thieno[3,2-b]pyridin-2-yl)sulfanyl]ethanoyl]carbamate Openeye Name: ethyl N-[2-[(3-cyano-5-hydroxy-7-oxo-4H-thieno[3,2-b]pyridin-2-yl)sulfanyl]acetyl]carbamate CAS Name: N-[2-[(3-cyano-5-hydroxy-7-oxo-4H-thieno[3,2-b]pyridin-2-yl)thio]-1-oxoethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-[(3-cyano-5-hydroxy-7-oxo-4H-thieno[3,2-b]pyridin-2-yl)sulfanyl]acetyl]carbamate Traditional Name: N-[2-[(3-cyano-5-hydroxy-7-keto-4H-thieno[3,2-b]pyridin-2-yl)thio]acetyl]carbamic acid ethyl ester Formula: C13H11N3O5S2 MolecularWeight: 353.37354

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=O)CSC1=C(C2=C(S1)C(=O)C=C(N2)O)C#N

Isomeric SMILES

CCOC(=O)NC(=O)CSC1=C(C2=C(S1)C(=O)C=C(N2)O)C#N

InChI

InChI=1S/C13H11N3O5S2/c1-2-21-13(20)16-9(19)5-22-12-6(4-14)10-11(23-12)7(17)3-8(18)15-10/h3H,2,5H2,1H3,(H2,15,17,18)(H,16,19,20)