(2-fluorophenyl)methyl 2-(2-cyanophenyl)sulfanylbenzoate

Systemtic Name: (2-fluorophenyl)methyl 2-(2-cyanophenyl)sulfanylbenzoate Openeye Name: (2-fluorophenyl)methyl 2-(2-cyanophenyl)sulfanylbenzoate CAS Name: 2-[(2-cyanophenyl)thio]benzoic acid (2-fluorophenyl)methyl ester IUPAC Name: (2-fluorophenyl)methyl 2-(2-cyanophenyl)sulfanylbenzoate Traditional Name: 2-[(2-cyanophenyl)thio]benzoic acid (2-fluorobenzyl) ester Formula: C21H14FNO2S MolecularWeight: 363.404763

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N)F

Isomeric SMILES

C1=CC=C(C(=C1)COC(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N)F

InChI

InChI=1S/C21H14FNO2S/c22-18-10-4-1-8-16(18)14-25-21(24)17-9-3-6-12-20(17)26-19-11-5-2-7-15(19)13-23/h1-12H,14H2