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

Systemtic Name: N-[3-[4-(4-chlorophenyl)piperazin-1-yl]propyl]-3-fluoranyl-4-methoxy-benzenesulfonamide Openeye Name: N-[3-[4-(4-chlorophenyl)piperazin-1-yl]propyl]-3-fluoro-4-methoxy-benzenesulfonamide CAS Name: N-[3-[4-(4-chlorophenyl)-1-piperazinyl]propyl]-3-fluoro-4-methoxybenzenesulfonamide IUPAC Name: N-[3-[4-(4-chlorophenyl)piperazin-1-yl]propyl]-3-fluoro-4-methoxybenzenesulfonamide Traditional Name: N-[3-[4-(4-chlorophenyl)piperazino]propyl]-3-fluoro-4-methoxy-benzenesulfonamide Formula: C20H25ClFN3O3S MolecularWeight: 441.947203

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NCCCN2CCN(CC2)C3=CC=C(C=C3)Cl)F

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NCCCN2CCN(CC2)C3=CC=C(C=C3)Cl)F

InChI

InChI=1S/C20H25ClFN3O3S/c1-28-20-8-7-18(15-19(20)22)29(26,27)23-9-2-10-24-11-13-25(14-12-24)17-5-3-16(21)4-6-17/h3-8,15,23H,2,9-14H2,1H3