4-fluoranyl-N-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-3-methyl-benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-3-methyl-benzenesulfonamide Openeye Name: 4-fluoro-N-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-3-methyl-benzenesulfonamide CAS Name: 4-fluoro-N-[3-[4-(2-methoxyphenyl)-1-piperazinyl]propyl]-3-methylbenzenesulfonamide IUPAC Name: 4-fluoro-N-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-3-methylbenzenesulfonamide Traditional Name: 4-fluoro-N-[3-[4-(2-methoxyphenyl)piperazino]propyl]-3-methyl-benzenesulfonamide Formula: C21H28FN3O3S MolecularWeight: 421.528723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)NCCCN2CCN(CC2)C3=CC=CC=C3OC)F

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)NCCCN2CCN(CC2)C3=CC=CC=C3OC)F

InChI

InChI=1S/C21H28FN3O3S/c1-17-16-18(8-9-19(17)22)29(26,27)23-10-5-11-24-12-14-25(15-13-24)20-6-3-4-7-21(20)28-2/h3-4,6-9,16,23H,5,10-15H2,1-2H3