1-phenyl-4-[[2-(trifluoromethyl)phenyl]methylsulfanyl]phthalazine

Systemtic Name: 1-phenyl-4-[[2-(trifluoromethyl)phenyl]methylsulfanyl]phthalazine Openeye Name: 1-phenyl-4-[[2-(trifluoromethyl)phenyl]methylsulfanyl]phthalazine CAS Name: 1-phenyl-4-[[2-(trifluoromethyl)phenyl]methylthio]phthalazine IUPAC Name: 1-phenyl-4-[[2-(trifluoromethyl)phenyl]methylsulfanyl]phthalazine Traditional Name: 1-phenyl-4-[[2-(trifluoromethyl)benzyl]thio]phthalazine Formula: C22H15F3N2S MolecularWeight: 396.42811

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)SCC4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)SCC4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C22H15F3N2S/c23-22(24,25)19-13-7-4-10-16(19)14-28-21-18-12-6-5-11-17(18)20(26-27-21)15-8-2-1-3-9-15/h1-13H,14H2