1-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-yl]-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanyl-ethanone

Systemtic Name: 1-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-yl]-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanyl-ethanone Openeye Name: 1-[4-(4-acetyl-2-fluoro-phenyl)piperazin-1-yl]-2-[2-(2-furyl)quinazolin-4-yl]sulfanyl-ethanone CAS Name: 1-[4-(4-acetyl-2-fluorophenyl)-1-piperazinyl]-2-[[2-(2-furanyl)-4-quinazolinyl]thio]ethanone IUPAC Name: 1-[4-(4-acetyl-2-fluorophenyl)piperazin-1-yl]-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanylethanone Traditional Name: 1-[4-(4-acetyl-2-fluoro-phenyl)piperazino]-2-[[2-(2-furyl)quinazolin-4-yl]thio]ethanone Formula: C26H23FN4O3S MolecularWeight: 490.549223

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)CSC3=NC(=NC4=CC=CC=C43)C5=CC=CO5)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)CSC3=NC(=NC4=CC=CC=C43)C5=CC=CO5)F

InChI

InChI=1S/C26H23FN4O3S/c1-17(32)18-8-9-22(20(27)15-18)30-10-12-31(13-11-30)24(33)16-35-26-19-5-2-3-6-21(19)28-25(29-26)23-7-4-14-34-23/h2-9,14-15H,10-13,16H2,1H3