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

Systemtic Name: 4-ethoxy-3-fluoranyl-N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]benzenesulfonamide Openeye Name: 4-ethoxy-3-fluoro-N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]benzenesulfonamide CAS Name: 4-ethoxy-3-fluoro-N-[3-[4-(4-methoxyphenyl)-1-piperazinyl]propyl]benzenesulfonamide IUPAC Name: 4-ethoxy-3-fluoro-N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]benzenesulfonamide Traditional Name: 4-ethoxy-3-fluoro-N-[3-[4-(4-methoxyphenyl)piperazino]propyl]benzenesulfonamide Formula: C22H30FN3O4S MolecularWeight: 451.554703

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30FN3O4S/c1-3-30-22-10-9-20(17-21(22)23)31(27,28)24-11-4-12-25-13-15-26(16-14-25)18-5-7-19(29-2)8-6-18/h5-10,17,24H,3-4,11-16H2,1-2H3