(2-bromanyl-4-cyano-6-ethoxy-phenyl) 2-(4-fluorophenyl)sulfanylethanoate

Systemtic Name: (2-bromanyl-4-cyano-6-ethoxy-phenyl) 2-(4-fluorophenyl)sulfanylethanoate Openeye Name: (2-bromo-4-cyano-6-ethoxy-phenyl) 2-(4-fluorophenyl)sulfanylacetate CAS Name: 2-[(4-fluorophenyl)thio]acetic acid (2-bromo-4-cyano-6-ethoxyphenyl) ester IUPAC Name: (2-bromo-4-cyano-6-ethoxyphenyl) 2-(4-fluorophenyl)sulfanylacetate Traditional Name: 2-[(4-fluorophenyl)thio]acetic acid (2-bromo-4-cyano-6-ethoxy-phenyl) ester Formula: C17H13BrFNO3S MolecularWeight: 410.257423

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C#N)Br)OC(=O)CSC2=CC=C(C=C2)F

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C#N)Br)OC(=O)CSC2=CC=C(C=C2)F

InChI

InChI=1S/C17H13BrFNO3S/c1-2-22-15-8-11(9-20)7-14(18)17(15)23-16(21)10-24-13-5-3-12(19)4-6-13/h3-8H,2,10H2,1H3