(4-cyano-2-fluoranyl-phenyl)methyl 2-(oxolan-2-ylmethylsulfanyl)benzoate

Systemtic Name: (4-cyano-2-fluoranyl-phenyl)methyl 2-(oxolan-2-ylmethylsulfanyl)benzoate Openeye Name: (4-cyano-2-fluoro-phenyl)methyl 2-(tetrahydrofuran-2-ylmethylsulfanyl)benzoate CAS Name: 2-(2-oxolanylmethylthio)benzoic acid (4-cyano-2-fluorophenyl)methyl ester IUPAC Name: (4-cyano-2-fluorophenyl)methyl 2-(oxolan-2-ylmethylsulfanyl)benzoate Traditional Name: 2-(tetrahydrofurfurylthio)benzoic acid (4-cyano-2-fluoro-benzyl) ester Formula: C20H18FNO3S MolecularWeight: 371.425223

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CSC2=CC=CC=C2C(=O)OCC3=C(C=C(C=C3)C#N)F

Isomeric SMILES

C1CC(OC1)CSC2=CC=CC=C2C(=O)OCC3=C(C=C(C=C3)C#N)F

InChI

InChI=1S/C20H18FNO3S/c21-18-10-14(11-22)7-8-15(18)12-25-20(23)17-5-1-2-6-19(17)26-13-16-4-3-9-24-16/h1-2,5-8,10,16H,3-4,9,12-13H2