1-[2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-6-fluoranyl-phenyl]ethanone

Systemtic Name: 1-[2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-6-fluoranyl-phenyl]ethanone Openeye Name: 1-[2-fluoro-6-[4-(4-sec-butylphenyl)sulfonylpiperazin-1-yl]phenyl]ethanone CAS Name: 1-[2-[4-(4-butan-2-ylphenyl)sulfonyl-1-piperazinyl]-6-fluorophenyl]ethanone IUPAC Name: 1-[2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-6-fluorophenyl]ethanone Traditional Name: 1-[2-fluoro-6-[4-(4-sec-butylphenyl)sulfonylpiperazino]phenyl]ethanone Formula: C22H27FN2O3S MolecularWeight: 418.524783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27FN2O3S/c1-4-16(2)18-8-10-19(11-9-18)29(27,28)25-14-12-24(13-15-25)21-7-5-6-20(23)22(21)17(3)26/h5-11,16H,4,12-15H2,1-3H3