1-[3,4-bis(oxidanyl)phenyl]-2-(4-methylquinolin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-[3,4-bis(oxidanyl)phenyl]-2-(4-methylquinolin-2-yl)sulfanyl-ethanone Openeye Name: 1-(3,4-dihydroxyphenyl)-2-[(4-methyl-2-quinolyl)sulfanyl]ethanone CAS Name: 1-(3,4-dihydroxyphenyl)-2-[(4-methyl-2-quinolinyl)thio]ethanone IUPAC Name: 1-(3,4-dihydroxyphenyl)-2-(4-methylquinolin-2-yl)sulfanylethanone Traditional Name: 1-(3,4-dihydroxyphenyl)-2-[(4-methyl-2-quinolyl)thio]ethanone Formula: C18H15NO3S MolecularWeight: 325.3816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC(=O)C3=CC(=C(C=C3)O)O

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC(=O)C3=CC(=C(C=C3)O)O

InChI

InChI=1S/C18H15NO3S/c1-11-8-18(19-14-5-3-2-4-13(11)14)23-10-17(22)12-6-7-15(20)16(21)9-12/h2-9,20-21H,10H2,1H3