(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-(2-fluorophenyl)sulfanylethanoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-(2-fluorophenyl)sulfanylethanoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 2-(2-fluorophenyl)sulfanylacetate CAS Name: 2-[(2-fluorophenyl)thio]acetic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 2-(2-fluorophenyl)sulfanylacetate Traditional Name: 2-[(2-fluorophenyl)thio]acetic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C14H13FN2O3S MolecularWeight: 308.328023

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)CSC1=CC=CC=C1F

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)CSC1=CC=CC=C1F

InChI

InChI=1S/C14H13FN2O3S/c1-9(17)10(6-16)12(18)7-20-14(19)8-21-13-5-3-2-4-11(13)15/h2-5,10,17H,7-8H2,1H3