1-[3-fluoranyl-4-[4-(2-morpholin-4-yl-5-propylsulfonyl-phenyl)carbonylpiperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[3-fluoranyl-4-[4-(2-morpholin-4-yl-5-propylsulfonyl-phenyl)carbonylpiperazin-1-yl]phenyl]ethanone Openeye Name: 1-[3-fluoro-4-[4-(2-morpholino-5-propylsulfonyl-benzoyl)piperazin-1-yl]phenyl]ethanone CAS Name: 1-[3-fluoro-4-[4-[[2-(4-morpholinyl)-5-propylsulfonylphenyl]-oxomethyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[3-fluoro-4-[4-(2-morpholin-4-yl-5-propylsulfonylbenzoyl)piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[3-fluoro-4-[4-(2-morpholino-5-propylsulfonyl-benzoyl)piperazino]phenyl]ethanone Formula: C26H32FN3O5S MolecularWeight: 517.612783

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=CC(=C(C=C1)N2CCOCC2)C(=O)N3CCN(CC3)C4=C(C=C(C=C4)C(=O)C)F

Isomeric SMILES

CCCS(=O)(=O)C1=CC(=C(C=C1)N2CCOCC2)C(=O)N3CCN(CC3)C4=C(C=C(C=C4)C(=O)C)F

InChI

InChI=1S/C26H32FN3O5S/c1-3-16-36(33,34)21-5-7-24(29-12-14-35-15-13-29)22(18-21)26(32)30-10-8-28(9-11-30)25-6-4-20(19(2)31)17-23(25)27/h4-7,17-18H,3,8-16H2,1-2H3