1-[2-fluoranyl-4-[4-[2-(2-methylpropoxy)-5-methylsulfonyl-phenyl]carbonylpiperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[2-fluoranyl-4-[4-[2-(2-methylpropoxy)-5-methylsulfonyl-phenyl]carbonylpiperazin-1-yl]phenyl]ethanone Openeye Name: 1-[2-fluoro-4-[4-(2-isobutoxy-5-methylsulfonyl-benzoyl)piperazin-1-yl]phenyl]ethanone CAS Name: 1-[2-fluoro-4-[4-[[2-(2-methylpropoxy)-5-methylsulfonylphenyl]-oxomethyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[2-fluoro-4-[4-[2-(2-methylpropoxy)-5-methylsulfonylbenzoyl]piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[2-fluoro-4-[4-(2-isobutoxy-5-mesyl-benzoyl)piperazino]phenyl]ethanone Formula: C24H29FN2O5S MolecularWeight: 476.560863

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)C(=O)C)F

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)C(=O)C)F

InChI

InChI=1S/C24H29FN2O5S/c1-16(2)15-32-23-8-6-19(33(4,30)31)14-21(23)24(29)27-11-9-26(10-12-27)18-5-7-20(17(3)28)22(25)13-18/h5-8,13-14,16H,9-12,15H2,1-4H3