2-[6-(2,4-dimethylphenyl)pyridazin-3-yl]sulfanyl-N-[(4-fluorophenyl)methyl]ethanamide

Systemtic Name: 2-[6-(2,4-dimethylphenyl)pyridazin-3-yl]sulfanyl-N-[(4-fluorophenyl)methyl]ethanamide Openeye Name: 2-[6-(2,4-dimethylphenyl)pyridazin-3-yl]sulfanyl-N-[(4-fluorophenyl)methyl]acetamide CAS Name: 2-[[6-(2,4-dimethylphenyl)-3-pyridazinyl]thio]-N-[(4-fluorophenyl)methyl]acetamide IUPAC Name: 2-[6-(2,4-dimethylphenyl)pyridazin-3-yl]sulfanyl-N-[(4-fluorophenyl)methyl]acetamide Traditional Name: 2-[[6-(2,4-dimethylphenyl)pyridazin-3-yl]thio]-N-(4-fluorobenzyl)acetamide Formula: C21H20FN3OS MolecularWeight: 381.466403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NN=C(C=C2)SCC(=O)NCC3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NN=C(C=C2)SCC(=O)NCC3=CC=C(C=C3)F)C

InChI

InChI=1S/C21H20FN3OS/c1-14-3-8-18(15(2)11-14)19-9-10-21(25-24-19)27-13-20(26)23-12-16-4-6-17(22)7-5-16/h3-11H,12-13H2,1-2H3,(H,23,26)