2-[2-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-yl]carbonylphenyl]sulfanyl-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[2-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-yl]carbonylphenyl]sulfanyl-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[2-[4-(4-acetyl-2-fluoro-phenyl)piperazine-1-carbonyl]phenyl]sulfanyl-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[[2-[[4-(4-acetyl-2-fluorophenyl)-1-piperazinyl]-oxomethyl]phenyl]thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[2-[4-(4-acetyl-2-fluorophenyl)piperazine-1-carbonyl]phenyl]sulfanyl-1-pyrrolidin-1-ylethanone Traditional Name: 2-[[2-[4-(4-acetyl-2-fluoro-phenyl)piperazine-1-carbonyl]phenyl]thio]-1-pyrrolidino-ethanone Formula: C25H28FN3O3S MolecularWeight: 469.571523

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)N4CCCC4)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3SCC(=O)N4CCCC4)F

InChI

InChI=1S/C25H28FN3O3S/c1-18(30)19-8-9-22(21(26)16-19)27-12-14-29(15-13-27)25(32)20-6-2-3-7-23(20)33-17-24(31)28-10-4-5-11-28/h2-3,6-9,16H,4-5,10-15,17H2,1H3