2-[ethyl-(phenylmethyl)amino]-1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-[ethyl-(phenylmethyl)amino]-1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-[benzyl(ethyl)amino]-1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 2-[ethyl-(phenylmethyl)amino]-1-[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-[benzyl(ethyl)amino]-1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-[benzyl(ethyl)amino]-1-[4-(3-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=CC(=C3)F

Isomeric SMILES

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

InChI

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