[2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] 3,5-bis(fluoranyl)benzoate

Systemtic Name: [2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] 3,5-bis(fluoranyl)benzoate Openeye Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 3,5-difluorobenzoate CAS Name: 3,5-difluorobenzoic acid [2-oxo-2-[3-(phenylthio)propylamino]ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 3,5-difluorobenzoate Traditional Name: 3,5-difluorobenzoic acid [2-keto-2-[3-(phenylthio)propylamino]ethyl] ester Formula: C18H17F2NO3S MolecularWeight: 365.394286

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17F2NO3S/c19-14-9-13(10-15(20)11-14)18(23)24-12-17(22)21-7-4-8-25-16-5-2-1-3-6-16/h1-3,5-6,9-11H,4,7-8,12H2,(H,21,22)