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

Systemtic Name: methyl 2-[(4-methoxyphenyl)methylsulfanyl]quinoline-3-carboxylate Openeye Name: methyl 2-[(4-methoxyphenyl)methylsulfanyl]quinoline-3-carboxylate CAS Name: 2-[(4-methoxyphenyl)methylthio]-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(4-methoxyphenyl)methylsulfanyl]quinoline-3-carboxylate Traditional Name: 2-(p-anisylthio)quinoline-3-carboxylic acid methyl ester Formula: C19H17NO3S MolecularWeight: 339.40818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C=C2C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C=C2C(=O)OC

InChI

InChI=1S/C19H17NO3S/c1-22-15-9-7-13(8-10-15)12-24-18-16(19(21)23-2)11-14-5-3-4-6-17(14)20-18/h3-11H,12H2,1-2H3