1-(1-adamantyl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(1-adamantyl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanone Openeye Name: 1-(1-adamantyl)-2-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanyl]ethanone CAS Name: 1-(1-adamantyl)-2-[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]ethanone IUPAC Name: 1-(1-adamantyl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylethanone Traditional Name: 1-(1-adamantyl)-2-[(5-piperidinosulfonyl-2-pyridyl)thio]ethanone Formula: C22H30N2O3S2 MolecularWeight: 434.6152

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H30N2O3S2/c25-20(22-11-16-8-17(12-22)10-18(9-16)13-22)15-28-21-5-4-19(14-23-21)29(26,27)24-6-2-1-3-7-24/h4-5,14,16-18H,1-3,6-13,15H2