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

Systemtic Name: 1-(1-adamantyl)-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-(1-adamantyl)-2-(4-benzylsulfonylpiperazin-1-yl)ethanone CAS Name: 1-(1-adamantyl)-2-[4-(phenylmethyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 1-(1-adamantyl)-2-(4-benzylsulfonylpiperazin-1-yl)ethanone Traditional Name: 1-(1-adamantyl)-2-(4-benzylsulfonylpiperazino)ethanone Formula: C23H32N2O3S MolecularWeight: 416.57678

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)C23CC4CC(C2)CC(C4)C3)S(=O)(=O)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC(=O)C23CC4CC(C2)CC(C4)C3)S(=O)(=O)CC5=CC=CC=C5

InChI

InChI=1S/C23H32N2O3S/c26-22(23-13-19-10-20(14-23)12-21(11-19)15-23)16-24-6-8-25(9-7-24)29(27,28)17-18-4-2-1-3-5-18/h1-5,19-21H,6-17H2