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

Systemtic Name: 2-[1-adamantylmethyl(methyl)amino]-1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-[1-adamantylmethyl(methyl)amino]-1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 2-[1-adamantylmethyl(methyl)amino]-1-[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-[1-adamantylmethyl(methyl)amino]-1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-[1-adamantylmethyl(methyl)amino]-1-[4-(3-fluorophenyl)sulfonylpiperazino]ethanone Formula: C24H34FN3O3S MolecularWeight: 463.608463

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)F)CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CN(CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)F)CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H34FN3O3S/c1-26(17-24-13-18-9-19(14-24)11-20(10-18)15-24)16-23(29)27-5-7-28(8-6-27)32(30,31)22-4-2-3-21(25)12-22/h2-4,12,18-20H,5-11,13-17H2,1H3