N-[(3-chlorophenyl)methyl]-2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-ethanamide

Systemtic Name: N-[(3-chlorophenyl)methyl]-2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-ethanamide Openeye Name: N-[(3-chlorophenyl)methyl]-2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-acetamide CAS Name: N-[(3-chlorophenyl)methyl]-2-[[4-(4-fluorophenyl)-1-phthalazinyl]thio]acetamide IUPAC Name: N-[(3-chlorophenyl)methyl]-2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylacetamide Traditional Name: N-(3-chlorobenzyl)-2-[[4-(4-fluorophenyl)phthalazin-1-yl]thio]acetamide Formula: C23H17ClFN3OS MolecularWeight: 437.916983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN=C2SCC(=O)NCC3=CC(=CC=C3)Cl)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN=C2SCC(=O)NCC3=CC(=CC=C3)Cl)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H17ClFN3OS/c24-17-5-3-4-15(12-17)13-26-21(29)14-30-23-20-7-2-1-6-19(20)22(27-28-23)16-8-10-18(25)11-9-16/h1-12H,13-14H2,(H,26,29)