4,6,6-trimethyl-3-[3-(trifluoromethyl)phenyl]-1H-pyrimidine-2-thione

Systemtic Name: 4,6,6-trimethyl-3-[3-(trifluoromethyl)phenyl]-1H-pyrimidine-2-thione Openeye Name: 4,6,6-trimethyl-3-[3-(trifluoromethyl)phenyl]-1H-pyrimidine-2-thione CAS Name: 4,6,6-trimethyl-3-[3-(trifluoromethyl)phenyl]-1H-pyrimidine-2-thione IUPAC Name: 4,6,6-trimethyl-3-[3-(trifluoromethyl)phenyl]-1H-pyrimidine-2-thione Traditional Name: 4,6,6-trimethyl-3-[3-(trifluoromethyl)phenyl]-1H-pyrimidine-2-thione Formula: C14H15F3N2S MolecularWeight: 300.34251

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(NC(=S)N1C2=CC=CC(=C2)C(F)(F)F)(C)C

Isomeric SMILES

CC1=CC(NC(=S)N1C2=CC=CC(=C2)C(F)(F)F)(C)C

InChI

InChI=1S/C14H15F3N2S/c1-9-8-13(2,3)18-12(20)19(9)11-6-4-5-10(7-11)14(15,16)17/h4-8H,1-3H3,(H,18,20)