[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 3,4-bis(fluoranyl)benzoate

Systemtic Name: [2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 3,4-bis(fluoranyl)benzoate Openeye Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 3,4-difluorobenzoate CAS Name: 3,4-difluorobenzoic acid [2-oxo-2-[2-(phenylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 3,4-difluorobenzoate Traditional Name: 3,4-difluorobenzoic acid [2-keto-2-[2-(phenylthio)ethylamino]ethyl] ester Formula: C17H15F2NO3S MolecularWeight: 351.367706

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCNC(=O)COC(=O)C2=CC(=C(C=C2)F)F

Isomeric SMILES

C1=CC=C(C=C1)SCCNC(=O)COC(=O)C2=CC(=C(C=C2)F)F

InChI

InChI=1S/C17H15F2NO3S/c18-14-7-6-12(10-15(14)19)17(22)23-11-16(21)20-8-9-24-13-4-2-1-3-5-13/h1-7,10H,8-9,11H2,(H,20,21)