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

Systemtic Name: 1-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-yl]-2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-ethanone Openeye Name: 1-[4-(4-acetyl-2-fluoro-phenyl)piperazin-1-yl]-2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-ethanone CAS Name: 1-[4-(4-acetyl-2-fluorophenyl)-1-piperazinyl]-2-[[4-(ethylamino)-2-quinazolinyl]thio]ethanone IUPAC Name: 1-[4-(4-acetyl-2-fluorophenyl)piperazin-1-yl]-2-[4-(ethylamino)quinazolin-2-yl]sulfanylethanone Traditional Name: 1-[4-(4-acetyl-2-fluoro-phenyl)piperazino]-2-[[4-(ethylamino)quinazolin-2-yl]thio]ethanone Formula: C24H26FN5O2S MolecularWeight: 467.558943

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC2=CC=CC=C21)SCC(=O)N3CCN(CC3)C4=C(C=C(C=C4)C(=O)C)F

Isomeric SMILES

CCNC1=NC(=NC2=CC=CC=C21)SCC(=O)N3CCN(CC3)C4=C(C=C(C=C4)C(=O)C)F

InChI

InChI=1S/C24H26FN5O2S/c1-3-26-23-18-6-4-5-7-20(18)27-24(28-23)33-15-22(32)30-12-10-29(11-13-30)21-9-8-17(16(2)31)14-19(21)25/h4-9,14H,3,10-13,15H2,1-2H3,(H,26,27,28)