2-[cycloheptyl(methyl)amino]-1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-[cycloheptyl(methyl)amino]-1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-[cycloheptyl(methyl)amino]-1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 2-[cycloheptyl(methyl)amino]-1-[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-[cycloheptyl(methyl)amino]-1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-[cycloheptyl(methyl)amino]-1-[4-(3-fluorophenyl)sulfonylpiperazino]ethanone Formula: C20H30FN3O3S MolecularWeight: 411.533903

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)F)C3CCCCCC3

Isomeric SMILES

CN(CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)F)C3CCCCCC3

InChI

InChI=1S/C20H30FN3O3S/c1-22(18-8-4-2-3-5-9-18)16-20(25)23-11-13-24(14-12-23)28(26,27)19-10-6-7-17(21)15-19/h6-7,10,15,18H,2-5,8-9,11-14,16H2,1H3