3-[2,5-bis(fluoranyl)-4-methyl-phenyl]-1-methyl-2-sulfanylidene-6-(trifluoromethyl)pyrimidin-4-one

Systemtic Name: 3-[2,5-bis(fluoranyl)-4-methyl-phenyl]-1-methyl-2-sulfanylidene-6-(trifluoromethyl)pyrimidin-4-one Openeye Name: 3-(2,5-difluoro-4-methyl-phenyl)-1-methyl-2-thioxo-6-(trifluoromethyl)pyrimidin-4-one CAS Name: 3-(2,5-difluoro-4-methylphenyl)-1-methyl-2-sulfanylidene-6-(trifluoromethyl)-4-pyrimidinone IUPAC Name: 3-(2,5-difluoro-4-methylphenyl)-1-methyl-2-sulfanylidene-6-(trifluoromethyl)pyrimidin-4-one Traditional Name: 3-(2,5-difluoro-4-methyl-phenyl)-1-methyl-2-thioxo-6-(trifluoromethyl)pyrimidin-4-one Formula: C13H9F5N2OS MolecularWeight: 336.280376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1F)N2C(=O)C=C(N(C2=S)C)C(F)(F)F)F

Isomeric SMILES

CC1=CC(=C(C=C1F)N2C(=O)C=C(N(C2=S)C)C(F)(F)F)F

InChI

InChI=1S/C13H9F5N2OS/c1-6-3-8(15)9(4-7(6)14)20-11(21)5-10(13(16,17)18)19(2)12(20)22/h3-5H,1-2H3