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

Systemtic Name: methyl 4-[(2-methylphenyl)methoxy]-2-methylsulfanyl-quinoline-3-carboxylate Openeye Name: methyl 2-methylsulfanyl-4-(o-tolylmethoxy)quinoline-3-carboxylate CAS Name: 4-[(2-methylphenyl)methoxy]-2-(methylthio)-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-[(2-methylphenyl)methoxy]-2-methylsulfanylquinoline-3-carboxylate Traditional Name: 4-(2-methylbenzyl)oxy-2-(methylthio)quinoline-3-carboxylic acid methyl ester Formula: C20H19NO3S MolecularWeight: 353.43476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1COC2=C(C(=NC3=CC=CC=C32)SC)C(=O)OC

Isomeric SMILES

CC1=CC=CC=C1COC2=C(C(=NC3=CC=CC=C32)SC)C(=O)OC

InChI

InChI=1S/C20H19NO3S/c1-13-8-4-5-9-14(13)12-24-18-15-10-6-7-11-16(15)21-19(25-3)17(18)20(22)23-2/h4-11H,12H2,1-3H3