4-(4-fluorophenyl)-5-(4-methylsulfanylphenyl)-2-[(E)-2,3,3-tris(fluoranyl)prop-1-enyl]pyridazin-3-one

Systemtic Name: 4-(4-fluorophenyl)-5-(4-methylsulfanylphenyl)-2-[(E)-2,3,3-tris(fluoranyl)prop-1-enyl]pyridazin-3-one Openeye Name: 4-(4-fluorophenyl)-5-(4-methylsulfanylphenyl)-2-[(E)-2,3,3-trifluoroprop-1-enyl]pyridazin-3-one CAS Name: 4-(4-fluorophenyl)-5-[4-(methylthio)phenyl]-2-[(E)-2,3,3-trifluoroprop-1-enyl]-3-pyridazinone IUPAC Name: 4-(4-fluorophenyl)-5-(4-methylsulfanylphenyl)-2-[(E)-2,3,3-trifluoroprop-1-enyl]pyridazin-3-one Traditional Name: 4-(4-fluorophenyl)-5-[4-(methylthio)phenyl]-2-[(E)-2,3,3-trifluoroprop-1-enyl]pyridazin-3-one Formula: C20H14F4N2OS MolecularWeight: 406.396573

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=C(C(=O)N(N=C2)C=C(C(F)F)F)C3=CC=C(C=C3)F

Isomeric SMILES

CSC1=CC=C(C=C1)C2=C(C(=O)N(N=C2)/C=C(\C(F)F)/F)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H14F4N2OS/c1-28-15-8-4-12(5-9-15)16-10-25-26(11-17(22)19(23)24)20(27)18(16)13-2-6-14(21)7-3-13/h2-11,19H,1H3/b17-11+