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

Systemtic Name: 6-[[3,5-bis(trifluoromethyl)phenyl]methyl]-5-methyl-2-sulfanylidene-1H-pyrimidin-4-one Openeye Name: 6-[[3,5-bis(trifluoromethyl)phenyl]methyl]-5-methyl-2-thioxo-1H-pyrimidin-4-one CAS Name: 6-[[3,5-bis(trifluoromethyl)phenyl]methyl]-5-methyl-2-sulfanylidene-1H-pyrimidin-4-one IUPAC Name: 6-[[3,5-bis(trifluoromethyl)phenyl]methyl]-5-methyl-2-sulfanylidene-1H-pyrimidin-4-one Traditional Name: 6-[3,5-bis(trifluoromethyl)benzyl]-5-methyl-2-thioxo-1H-pyrimidin-4-one Formula: C14H10F6N2OS MolecularWeight: 368.297419

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=S)NC1=O)CC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC1=C(NC(=S)NC1=O)CC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C14H10F6N2OS/c1-6-10(21-12(24)22-11(6)23)4-7-2-8(13(15,16)17)5-9(3-7)14(18,19)20/h2-3,5H,4H2,1H3,(H2,21,22,23,24)