2-[1-(2-fluorophenyl)ethylamino]-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-[1-(2-fluorophenyl)ethylamino]-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-[1-(2-fluorophenyl)ethylamino]ethanone CAS Name: 2-[1-(2-fluorophenyl)ethylamino]-1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-[1-(2-fluorophenyl)ethylamino]ethanone Traditional Name: 1-(4-benzylsulfonylpiperazino)-2-[1-(2-fluorophenyl)ethylamino]ethanone Formula: C21H26FN3O3S MolecularWeight: 419.512843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1F)NCC(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CC(C1=CC=CC=C1F)NCC(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H26FN3O3S/c1-17(19-9-5-6-10-20(19)22)23-15-21(26)24-11-13-25(14-12-24)29(27,28)16-18-7-3-2-4-8-18/h2-10,17,23H,11-16H2,1H3