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

Systemtic Name: N-[3-[4-(4-chlorophenyl)piperazin-1-yl]propyl]-4-ethoxy-3-fluoranyl-benzenesulfonamide Openeye Name: N-[3-[4-(4-chlorophenyl)piperazin-1-yl]propyl]-4-ethoxy-3-fluoro-benzenesulfonamide CAS Name: N-[3-[4-(4-chlorophenyl)-1-piperazinyl]propyl]-4-ethoxy-3-fluorobenzenesulfonamide IUPAC Name: N-[3-[4-(4-chlorophenyl)piperazin-1-yl]propyl]-4-ethoxy-3-fluorobenzenesulfonamide Traditional Name: N-[3-[4-(4-chlorophenyl)piperazino]propyl]-4-ethoxy-3-fluoro-benzenesulfonamide Formula: C21H27ClFN3O3S MolecularWeight: 455.973783

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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)Cl)F

Isomeric SMILES

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

InChI

InChI=1S/C21H27ClFN3O3S/c1-2-29-21-9-8-19(16-20(21)23)30(27,28)24-10-3-11-25-12-14-26(15-13-25)18-6-4-17(22)5-7-18/h4-9,16,24H,2-3,10-15H2,1H3