3-[[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-1H-quinoxalin-2-one

Systemtic Name: 3-[[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-1H-quinoxalin-2-one Openeye Name: 3-[[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-1H-quinoxalin-2-one CAS Name: 3-[[[4-methyl-6-(trifluoromethyl)-2-pyrimidinyl]thio]methyl]-1H-quinoxalin-2-one IUPAC Name: 3-[[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-1H-quinoxalin-2-one Traditional Name: 3-[[[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]thio]methyl]-1H-quinoxalin-2-one Formula: C15H11F3N4OS MolecularWeight: 352.33425

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=NC3=CC=CC=C3NC2=O)C(F)(F)F

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=NC3=CC=CC=C3NC2=O)C(F)(F)F

InChI

InChI=1S/C15H11F3N4OS/c1-8-6-12(15(16,17)18)22-14(19-8)24-7-11-13(23)21-10-5-3-2-4-9(10)20-11/h2-6H,7H2,1H3,(H,21,23)