(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 4-oxidanylidene-4-thiophen-2-yl-butanoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 4-oxidanylidene-4-thiophen-2-yl-butanoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 4-oxo-4-(2-thienyl)butanoate CAS Name: 4-oxo-4-thiophen-2-ylbutanoic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 4-oxo-4-thiophen-2-ylbutanoate Traditional Name: 4-keto-4-(2-thienyl)butyric acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C14H14N2O4S MolecularWeight: 306.33696

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)CCC(=O)C1=CC=CS1

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)CCC(=O)C1=CC=CS1

InChI

InChI=1S/C14H14N2O4S/c1-9(16)10(7-15)12(18)8-20-14(19)5-4-11(17)13-3-2-6-21-13/h2-3,6,10,16H,4-5,8H2,1H3