1-[4-[4-(2-cyclopentyloxy-5-methylsulfonyl-phenyl)carbonylpiperazin-1-yl]-3-fluoranyl-phenyl]ethanone

Systemtic Name: 1-[4-[4-(2-cyclopentyloxy-5-methylsulfonyl-phenyl)carbonylpiperazin-1-yl]-3-fluoranyl-phenyl]ethanone Openeye Name: 1-[4-[4-[2-(cyclopentoxy)-5-methylsulfonyl-benzoyl]piperazin-1-yl]-3-fluoro-phenyl]ethanone CAS Name: 1-[4-[4-[(2-cyclopentyloxy-5-methylsulfonylphenyl)-oxomethyl]-1-piperazinyl]-3-fluorophenyl]ethanone IUPAC Name: 1-[4-[4-(2-cyclopentyloxy-5-methylsulfonylbenzoyl)piperazin-1-yl]-3-fluorophenyl]ethanone Traditional Name: 1-[4-[4-[2-(cyclopentoxy)-5-mesyl-benzoyl]piperazino]-3-fluoro-phenyl]ethanone Formula: C25H29FN2O5S MolecularWeight: 488.571563

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)S(=O)(=O)C)OC4CCCC4)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)S(=O)(=O)C)OC4CCCC4)F

InChI

InChI=1S/C25H29FN2O5S/c1-17(29)18-7-9-23(22(26)15-18)27-11-13-28(14-12-27)25(30)21-16-20(34(2,31)32)8-10-24(21)33-19-5-3-4-6-19/h7-10,15-16,19H,3-6,11-14H2,1-2H3