[2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxidanylidene-ethyl] 5-(2-fluorophenyl)furan-2-carboxylate

Systemtic Name: [2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxidanylidene-ethyl] 5-(2-fluorophenyl)furan-2-carboxylate Openeye Name: [2-oxo-2-[2-(p-tolylsulfanyl)ethylamino]ethyl] 5-(2-fluorophenyl)furan-2-carboxylate CAS Name: 5-(2-fluorophenyl)-2-furancarboxylic acid [2-[2-[(4-methylphenyl)thio]ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxoethyl] 5-(2-fluorophenyl)furan-2-carboxylate Traditional Name: 5-(2-fluorophenyl)furan-2-carboxylic acid [2-keto-2-[2-(p-tolylthio)ethylamino]ethyl] ester Formula: C22H20FNO4S MolecularWeight: 413.461903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)COC(=O)C2=CC=C(O2)C3=CC=CC=C3F

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)COC(=O)C2=CC=C(O2)C3=CC=CC=C3F

InChI

InChI=1S/C22H20FNO4S/c1-15-6-8-16(9-7-15)29-13-12-24-21(25)14-27-22(26)20-11-10-19(28-20)17-4-2-3-5-18(17)23/h2-11H,12-14H2,1H3,(H,24,25)