3-(4-fluorophenyl)-1-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 3-(4-fluorophenyl)-1-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 3-(4-fluorophenyl)-1-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]propan-1-one CAS Name: 3-(4-fluorophenyl)-1-[4-(4-propylphenyl)sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 3-(4-fluorophenyl)-1-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 3-(4-fluorophenyl)-1-[4-(4-propylphenyl)sulfonylpiperazino]propan-1-one Formula: C22H27FN2O3S MolecularWeight: 418.524783

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC3=CC=C(C=C3)F

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC3=CC=C(C=C3)F

InChI

InChI=1S/C22H27FN2O3S/c1-2-3-18-6-11-21(12-7-18)29(27,28)25-16-14-24(15-17-25)22(26)13-8-19-4-9-20(23)10-5-19/h4-7,9-12H,2-3,8,13-17H2,1H3