methyl 4-[(4-bromophenyl)methoxy]-2-methylsulfanyl-quinoline-3-carboxylate

Systemtic Name: methyl 4-[(4-bromophenyl)methoxy]-2-methylsulfanyl-quinoline-3-carboxylate Openeye Name: methyl 4-[(4-bromophenyl)methoxy]-2-methylsulfanyl-quinoline-3-carboxylate CAS Name: 4-[(4-bromophenyl)methoxy]-2-(methylthio)-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-[(4-bromophenyl)methoxy]-2-methylsulfanylquinoline-3-carboxylate Traditional Name: 4-(4-bromobenzyl)oxy-2-(methylthio)quinoline-3-carboxylic acid methyl ester Formula: C19H16BrNO3S MolecularWeight: 418.30424

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2N=C1SC)OCC3=CC=C(C=C3)Br

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2N=C1SC)OCC3=CC=C(C=C3)Br

InChI

InChI=1S/C19H16BrNO3S/c1-23-19(22)16-17(24-11-12-7-9-13(20)10-8-12)14-5-3-4-6-15(14)21-18(16)25-2/h3-10H,11H2,1-2H3