2-[2-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-yl]carbonylphenyl]sulfanylethanamide

Systemtic Name: 2-[2-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-yl]carbonylphenyl]sulfanylethanamide Openeye Name: 2-[2-[4-(4-acetyl-2-fluoro-phenyl)piperazine-1-carbonyl]phenyl]sulfanylacetamide CAS Name: 2-[[2-[[4-(4-acetyl-2-fluorophenyl)-1-piperazinyl]-oxomethyl]phenyl]thio]acetamide IUPAC Name: 2-[2-[4-(4-acetyl-2-fluorophenyl)piperazine-1-carbonyl]phenyl]sulfanylacetamide Traditional Name: 2-[[2-[4-(4-acetyl-2-fluoro-phenyl)piperazine-1-carbonyl]phenyl]thio]acetamide Formula: C21H22FN3O3S MolecularWeight: 415.481083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3SCC(=O)N)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3SCC(=O)N)F

InChI

InChI=1S/C21H22FN3O3S/c1-14(26)15-6-7-18(17(22)12-15)24-8-10-25(11-9-24)21(28)16-4-2-3-5-19(16)29-13-20(23)27/h2-7,12H,8-11,13H2,1H3,(H2,23,27)