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

Systemtic Name: 2-[ethyl-(phenylmethyl)amino]-1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-[benzyl(ethyl)amino]-1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 2-[ethyl-(phenylmethyl)amino]-1-[4-(4-fluorophenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-[benzyl(ethyl)amino]-1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-[benzyl(ethyl)amino]-1-[4-(4-fluorophenyl)sulfonylpiperazino]ethanone Formula: C21H26FN3O3S MolecularWeight: 419.512843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26FN3O3S/c1-2-23(16-18-6-4-3-5-7-18)17-21(26)24-12-14-25(15-13-24)29(27,28)20-10-8-19(22)9-11-20/h3-11H,2,12-17H2,1H3