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

Systemtic Name: [2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 3-fluoranyl-4-methoxy-benzoate Openeye Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 3-fluoro-4-methoxy-benzoate CAS Name: 3-fluoro-4-methoxybenzoic acid [2-oxo-2-[2-(phenylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 3-fluoro-4-methoxybenzoate Traditional Name: 3-fluoro-4-methoxy-benzoic acid [2-keto-2-[2-(phenylthio)ethylamino]ethyl] ester Formula: C18H18FNO4S MolecularWeight: 363.403223

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCC(=O)NCCSC2=CC=CC=C2)F

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCC(=O)NCCSC2=CC=CC=C2)F

InChI

InChI=1S/C18H18FNO4S/c1-23-16-8-7-13(11-15(16)19)18(22)24-12-17(21)20-9-10-25-14-5-3-2-4-6-14/h2-8,11H,9-10,12H2,1H3,(H,20,21)