methyl 5-[[2-(2-cyanophenyl)sulfanylphenyl]carbonylamino]-2-fluoranyl-benzoate

Systemtic Name: methyl 5-[[2-(2-cyanophenyl)sulfanylphenyl]carbonylamino]-2-fluoranyl-benzoate Openeye Name: methyl 5-[[2-(2-cyanophenyl)sulfanylbenzoyl]amino]-2-fluoro-benzoate CAS Name: 5-[[[2-[(2-cyanophenyl)thio]phenyl]-oxomethyl]amino]-2-fluorobenzoic acid methyl ester IUPAC Name: methyl 5-[[2-(2-cyanophenyl)sulfanylbenzoyl]amino]-2-fluorobenzoate Traditional Name: 5-[[2-[(2-cyanophenyl)thio]benzoyl]amino]-2-fluoro-benzoic acid methyl ester Formula: C22H15FN2O3S MolecularWeight: 406.429503

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H15FN2O3S/c1-28-22(27)17-12-15(10-11-18(17)23)25-21(26)16-7-3-5-9-20(16)29-19-8-4-2-6-14(19)13-24/h2-12H,1H3,(H,25,26)