2-[(3-fluorophenyl)methyl-methyl-amino]-1-[4-(phenylsulfonyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[(3-fluorophenyl)methyl-methyl-amino]-1-[4-(phenylsulfonyl)piperazin-1-yl]ethanone Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-[(3-fluorophenyl)methyl-methyl-amino]ethanone CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-2-[(3-fluorophenyl)methyl-methylamino]ethanone IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-[(3-fluorophenyl)methyl-methylamino]ethanone Traditional Name: 1-(4-besylpiperazino)-2-[(3-fluorobenzyl)-methyl-amino]ethanone Formula: C20H24FN3O3S MolecularWeight: 405.486263

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)F)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN(CC1=CC(=CC=C1)F)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H24FN3O3S/c1-22(15-17-6-5-7-18(21)14-17)16-20(25)23-10-12-24(13-11-23)28(26,27)19-8-3-2-4-9-19/h2-9,14H,10-13,15-16H2,1H3