1-[2-[bis(fluoranyl)methoxy]-5-methyl-phenyl]-2-(4,8-dimethylquinolin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-[2-[bis(fluoranyl)methoxy]-5-methyl-phenyl]-2-(4,8-dimethylquinolin-2-yl)sulfanyl-ethanone Openeye Name: 1-[2-(difluoromethoxy)-5-methyl-phenyl]-2-[(4,8-dimethyl-2-quinolyl)sulfanyl]ethanone CAS Name: 1-[2-(difluoromethoxy)-5-methylphenyl]-2-[(4,8-dimethyl-2-quinolinyl)thio]ethanone IUPAC Name: 1-[2-(difluoromethoxy)-5-methylphenyl]-2-(4,8-dimethylquinolin-2-yl)sulfanylethanone Traditional Name: 1-[2-(difluoromethoxy)-5-methyl-phenyl]-2-[(4,8-dimethyl-2-quinolyl)thio]ethanone Formula: C21H19F2NO2S MolecularWeight: 387.442866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(F)F)C(=O)CSC2=NC3=C(C=CC=C3C)C(=C2)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC(F)F)C(=O)CSC2=NC3=C(C=CC=C3C)C(=C2)C

InChI

InChI=1S/C21H19F2NO2S/c1-12-7-8-18(26-21(22)23)16(9-12)17(25)11-27-19-10-14(3)15-6-4-5-13(2)20(15)24-19/h4-10,21H,11H2,1-3H3