2-(2-fluorophenyl)sulfanylethyl 2-(furan-2-yl)quinoline-4-carboxylate

Systemtic Name: 2-(2-fluorophenyl)sulfanylethyl 2-(furan-2-yl)quinoline-4-carboxylate Openeye Name: 2-(2-fluorophenyl)sulfanylethyl 2-(2-furyl)quinoline-4-carboxylate CAS Name: 2-(2-furanyl)-4-quinolinecarboxylic acid 2-[(2-fluorophenyl)thio]ethyl ester IUPAC Name: 2-(2-fluorophenyl)sulfanylethyl 2-(furan-2-yl)quinoline-4-carboxylate Traditional Name: 2-(2-furyl)cinchoninic acid 2-[(2-fluorophenyl)thio]ethyl ester Formula: C22H16FNO3S MolecularWeight: 393.430743

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CO3)C(=O)OCCSC4=CC=CC=C4F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CO3)C(=O)OCCSC4=CC=CC=C4F

InChI

InChI=1S/C22H16FNO3S/c23-17-7-2-4-10-21(17)28-13-12-27-22(25)16-14-19(20-9-5-11-26-20)24-18-8-3-1-6-15(16)18/h1-11,14H,12-13H2