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

Systemtic Name: 4-ethoxy-N-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]-3-methyl-benzenesulfonamide Openeye Name: 4-ethoxy-N-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]-3-methyl-benzenesulfonamide CAS Name: 4-ethoxy-N-[3-[4-(2-fluorophenyl)-1-piperazinyl]propyl]-3-methylbenzenesulfonamide IUPAC Name: 4-ethoxy-N-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]-3-methylbenzenesulfonamide Traditional Name: 4-ethoxy-N-[3-[4-(2-fluorophenyl)piperazino]propyl]-3-methyl-benzenesulfonamide Formula: C22H30FN3O3S MolecularWeight: 435.555303

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C22H30FN3O3S/c1-3-29-22-10-9-19(17-18(22)2)30(27,28)24-11-6-12-25-13-15-26(16-14-25)21-8-5-4-7-20(21)23/h4-5,7-10,17,24H,3,6,11-16H2,1-2H3