3-phenyl-2-[(E)-3-phenylprop-2-enyl]sulfanyl-6-(trifluoromethyl)pyrimidin-4-one

Systemtic Name: 3-phenyl-2-[(E)-3-phenylprop-2-enyl]sulfanyl-6-(trifluoromethyl)pyrimidin-4-one Openeye Name: 2-[(E)-cinnamyl]sulfanyl-3-phenyl-6-(trifluoromethyl)pyrimidin-4-one CAS Name: 3-phenyl-2-[[(E)-3-phenylprop-2-enyl]thio]-6-(trifluoromethyl)-4-pyrimidinone IUPAC Name: 3-phenyl-2-[(E)-3-phenylprop-2-enyl]sulfanyl-6-(trifluoromethyl)pyrimidin-4-one Traditional Name: 2-[[(E)-cinnamyl]thio]-3-phenyl-6-(trifluoromethyl)pyrimidin-4-one Formula: C20H15F3N2OS MolecularWeight: 388.40611

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CCSC2=NC(=CC(=O)N2C3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)/C=C/CSC2=NC(=CC(=O)N2C3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C20H15F3N2OS/c21-20(22,23)17-14-18(26)25(16-11-5-2-6-12-16)19(24-17)27-13-7-10-15-8-3-1-4-9-15/h1-12,14H,13H2/b10-7+