4-[[6-(4-fluorophenyl)pyridazin-3-yl]sulfanylmethyl]-N-(2-methylpropyl)benzamide

Systemtic Name: 4-[[6-(4-fluorophenyl)pyridazin-3-yl]sulfanylmethyl]-N-(2-methylpropyl)benzamide Openeye Name: 4-[[6-(4-fluorophenyl)pyridazin-3-yl]sulfanylmethyl]-N-isobutyl-benzamide CAS Name: 4-[[[6-(4-fluorophenyl)-3-pyridazinyl]thio]methyl]-N-(2-methylpropyl)benzamide IUPAC Name: 4-[[6-(4-fluorophenyl)pyridazin-3-yl]sulfanylmethyl]-N-(2-methylpropyl)benzamide Traditional Name: 4-[[[6-(4-fluorophenyl)pyridazin-3-yl]thio]methyl]-N-isobutyl-benzamide Formula: C22H22FN3OS MolecularWeight: 395.492983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CC=C(C=C1)CSC2=NN=C(C=C2)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)CNC(=O)C1=CC=C(C=C1)CSC2=NN=C(C=C2)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H22FN3OS/c1-15(2)13-24-22(27)18-5-3-16(4-6-18)14-28-21-12-11-20(25-26-21)17-7-9-19(23)10-8-17/h3-12,15H,13-14H2,1-2H3,(H,24,27)