[1-[(2-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(4-methylquinolin-2-yl)sulfanylethanoate

Systemtic Name: [1-[(2-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(4-methylquinolin-2-yl)sulfanylethanoate Openeye Name: [2-(2-fluoroanilino)-1-methyl-2-oxo-ethyl] 2-[(4-methyl-2-quinolyl)sulfanyl]acetate CAS Name: 2-[(4-methyl-2-quinolinyl)thio]acetic acid [1-(2-fluoroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-fluoroanilino)-1-oxopropan-2-yl] 2-(4-methylquinolin-2-yl)sulfanylacetate Traditional Name: 2-[(4-methyl-2-quinolyl)thio]acetic acid [2-(2-fluoroanilino)-2-keto-1-methyl-ethyl] ester Formula: C21H19FN2O3S MolecularWeight: 398.450563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC(=O)OC(C)C(=O)NC3=CC=CC=C3F

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC(=O)OC(C)C(=O)NC3=CC=CC=C3F

InChI

InChI=1S/C21H19FN2O3S/c1-13-11-19(23-17-9-5-3-7-15(13)17)28-12-20(25)27-14(2)21(26)24-18-10-6-4-8-16(18)22/h3-11,14H,12H2,1-2H3,(H,24,26)