(3-fluoranyl-4-methoxy-phenyl)methyl 2-(4-methylquinolin-2-yl)sulfanylethanoate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl 2-(4-methylquinolin-2-yl)sulfanylethanoate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl 2-[(4-methyl-2-quinolyl)sulfanyl]acetate CAS Name: 2-[(4-methyl-2-quinolinyl)thio]acetic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl 2-(4-methylquinolin-2-yl)sulfanylacetate Traditional Name: 2-[(4-methyl-2-quinolyl)thio]acetic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C20H18FNO3S MolecularWeight: 371.425223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC(=O)OCC3=CC(=C(C=C3)OC)F

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC(=O)OCC3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C20H18FNO3S/c1-13-9-19(22-17-6-4-3-5-15(13)17)26-12-20(23)25-11-14-7-8-18(24-2)16(21)10-14/h3-10H,11-12H2,1-2H3