1-(4-methylsulfanylphenyl)-2-[3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]ethanone

Systemtic Name: 1-(4-methylsulfanylphenyl)-2-[3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]ethanone Openeye Name: 2-[3-[6-(1-methyl-1-methylsulfonyl-ethyl)-8-quinolyl]phenyl]-1-(4-methylsulfanylphenyl)ethanone CAS Name: 2-[3-[6-(2-methylsulfonylpropan-2-yl)-8-quinolinyl]phenyl]-1-[4-(methylthio)phenyl]ethanone IUPAC Name: 1-(4-methylsulfanylphenyl)-2-[3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]ethanone Traditional Name: 2-[3-[6-(1-mesyl-1-methyl-ethyl)-8-quinolyl]phenyl]-1-[4-(methylthio)phenyl]ethanone Formula: C28H27NO3S2 MolecularWeight: 489.64888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)CC(=O)C4=CC=C(C=C4)SC)S(=O)(=O)C

Isomeric SMILES

CC(C)(C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)CC(=O)C4=CC=C(C=C4)SC)S(=O)(=O)C

InChI

InChI=1S/C28H27NO3S2/c1-28(2,34(4,31)32)23-17-22-9-6-14-29-27(22)25(18-23)21-8-5-7-19(15-21)16-26(30)20-10-12-24(33-3)13-11-20/h5-15,17-18H,16H2,1-4H3