N-(3-fluoranyl-4-methyl-phenyl)-2-[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-fluoranyl-4-methyl-phenyl)-2-[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]sulfanyl-ethanamide Openeye Name: N-(3-fluoro-4-methyl-phenyl)-2-[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-(3-fluoro-4-methylphenyl)-2-[[6-(2,4,5-trimethylphenyl)-3-pyridazinyl]thio]acetamide IUPAC Name: N-(3-fluoro-4-methylphenyl)-2-[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-2-[[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]thio]acetamide Formula: C22H22FN3OS MolecularWeight: 395.492983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(C=C2)C3=CC(=C(C=C3C)C)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(C=C2)C3=CC(=C(C=C3C)C)C)F

InChI

InChI=1S/C22H22FN3OS/c1-13-5-6-17(11-19(13)23)24-21(27)12-28-22-8-7-20(25-26-22)18-10-15(3)14(2)9-16(18)4/h5-11H,12H2,1-4H3,(H,24,27)