6-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-2-prop-2-ynyl-pyridazin-3-one

Systemtic Name: 6-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-2-prop-2-ynyl-pyridazin-3-one Openeye Name: 6-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-2-prop-2-ynyl-pyridazin-3-one CAS Name: 6-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-2-prop-2-ynyl-3-pyridazinone IUPAC Name: 6-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-2-prop-2-ynylpyridazin-3-one Traditional Name: 6-(4-fluorophenyl)-5-(4-mesylphenyl)-2-propargyl-pyridazin-3-one Formula: C20H15FN2O3S MolecularWeight: 382.408103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=CC(=O)N(N=C2C3=CC=C(C=C3)F)CC#C

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CC(=O)N(N=C2C3=CC=C(C=C3)F)CC#C

InChI

InChI=1S/C20H15FN2O3S/c1-3-12-23-19(24)13-18(14-6-10-17(11-7-14)27(2,25)26)20(22-23)15-4-8-16(21)9-5-15/h1,4-11,13H,12H2,2H3