methyl 2-[(4-fluorophenyl)sulfanylmethyl]-4-methyl-quinoline-3-carboxylate

Systemtic Name: methyl 2-[(4-fluorophenyl)sulfanylmethyl]-4-methyl-quinoline-3-carboxylate Openeye Name: methyl 2-[(4-fluorophenyl)sulfanylmethyl]-4-methyl-quinoline-3-carboxylate CAS Name: 2-[[(4-fluorophenyl)thio]methyl]-4-methyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(4-fluorophenyl)sulfanylmethyl]-4-methylquinoline-3-carboxylate Traditional Name: 2-[[(4-fluorophenyl)thio]methyl]-4-methyl-quinoline-3-carboxylic acid methyl ester Formula: C19H16FNO2S MolecularWeight: 341.399243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)CSC3=CC=C(C=C3)F)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)CSC3=CC=C(C=C3)F)C(=O)OC

InChI

InChI=1S/C19H16FNO2S/c1-12-15-5-3-4-6-16(15)21-17(18(12)19(22)23-2)11-24-14-9-7-13(20)8-10-14/h3-10H,11H2,1-2H3