1-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-2-quinolin-2-ylsulfanyl-ethanone

Systemtic Name: 1-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-2-quinolin-2-ylsulfanyl-ethanone Openeye Name: 1-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-2-(2-quinolylsulfanyl)ethanone CAS Name: 1-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-2-(2-quinolinylthio)ethanone IUPAC Name: 1-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-2-quinolin-2-ylsulfanylethanone Traditional Name: 1-(1-mesyl-3,4-dihydro-2H-quinolin-6-yl)-2-(2-quinolylthio)ethanone Formula: C21H20N2O3S2 MolecularWeight: 412.5251

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)CSC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)CSC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H20N2O3S2/c1-28(25,26)23-12-4-6-16-13-17(8-10-19(16)23)20(24)14-27-21-11-9-15-5-2-3-7-18(15)22-21/h2-3,5,7-11,13H,4,6,12,14H2,1H3