1-methyl-3-(methylsulfanylmethyl)-7-(trifluoromethyl)quinolin-4-one

Systemtic Name: 1-methyl-3-(methylsulfanylmethyl)-7-(trifluoromethyl)quinolin-4-one Openeye Name: 1-methyl-3-(methylsulfanylmethyl)-7-(trifluoromethyl)quinolin-4-one CAS Name: 1-methyl-3-[(methylthio)methyl]-7-(trifluoromethyl)-4-quinolinone IUPAC Name: 1-methyl-3-(methylsulfanylmethyl)-7-(trifluoromethyl)quinolin-4-one Traditional Name: 1-methyl-3-[(methylthio)methyl]-7-(trifluoromethyl)-4-quinolone Formula: C13H12F3NOS MolecularWeight: 287.30069

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)C2=C1C=C(C=C2)C(F)(F)F)CSC

Isomeric SMILES

CN1C=C(C(=O)C2=C1C=C(C=C2)C(F)(F)F)CSC

InChI

InChI=1S/C13H12F3NOS/c1-17-6-8(7-19-2)12(18)10-4-3-9(5-11(10)17)13(14,15)16/h3-6H,7H2,1-2H3