4-ethoxy-3-fluoranyl-N-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]benzenesulfonamide

Systemtic Name: 4-ethoxy-3-fluoranyl-N-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]benzenesulfonamide Openeye Name: 4-ethoxy-3-fluoro-N-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]benzenesulfonamide CAS Name: 4-ethoxy-3-fluoro-N-[3-[4-(2-fluorophenyl)-1-piperazinyl]propyl]benzenesulfonamide IUPAC Name: 4-ethoxy-3-fluoro-N-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]benzenesulfonamide Traditional Name: 4-ethoxy-3-fluoro-N-[3-[4-(2-fluorophenyl)piperazino]propyl]benzenesulfonamide Formula: C21H27F2N3O3S MolecularWeight: 439.519186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)NCCCN2CCN(CC2)C3=CC=CC=C3F)F

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)NCCCN2CCN(CC2)C3=CC=CC=C3F)F

InChI

InChI=1S/C21H27F2N3O3S/c1-2-29-21-9-8-17(16-19(21)23)30(27,28)24-10-5-11-25-12-14-26(15-13-25)20-7-4-3-6-18(20)22/h3-4,6-9,16,24H,2,5,10-15H2,1H3