4-(2-methylsulfanylpyrimidin-4-yl)-6-phenyl-3-[3-(trifluoromethyl)phenyl]pyridazine

Systemtic Name: 4-(2-methylsulfanylpyrimidin-4-yl)-6-phenyl-3-[3-(trifluoromethyl)phenyl]pyridazine Openeye Name: 4-(2-methylsulfanylpyrimidin-4-yl)-6-phenyl-3-[3-(trifluoromethyl)phenyl]pyridazine CAS Name: 4-[2-(methylthio)-4-pyrimidinyl]-6-phenyl-3-[3-(trifluoromethyl)phenyl]pyridazine IUPAC Name: 4-(2-methylsulfanylpyrimidin-4-yl)-6-phenyl-3-[3-(trifluoromethyl)phenyl]pyridazine Traditional Name: 4-[2-(methylthio)pyrimidin-4-yl]-6-phenyl-3-[3-(trifluoromethyl)phenyl]pyridazine Formula: C22H15F3N4S MolecularWeight: 424.44151

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=CC(=N1)C2=CC(=NN=C2C3=CC(=CC=C3)C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

CSC1=NC=CC(=N1)C2=CC(=NN=C2C3=CC(=CC=C3)C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C22H15F3N4S/c1-30-21-26-11-10-18(27-21)17-13-19(14-6-3-2-4-7-14)28-29-20(17)15-8-5-9-16(12-15)22(23,24)25/h2-13H,1H3