1-(1-adamantyl)-2-(6-methylpyridin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(1-adamantyl)-2-(6-methylpyridin-2-yl)sulfanyl-ethanone Openeye Name: 1-(1-adamantyl)-2-[(6-methyl-2-pyridyl)sulfanyl]ethanone CAS Name: 1-(1-adamantyl)-2-[(6-methyl-2-pyridinyl)thio]ethanone IUPAC Name: 1-(1-adamantyl)-2-(6-methylpyridin-2-yl)sulfanylethanone Traditional Name: 1-(1-adamantyl)-2-[(6-methyl-2-pyridyl)thio]ethanone Formula: C18H23NOS MolecularWeight: 301.44632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)SCC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=NC(=CC=C1)SCC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C18H23NOS/c1-12-3-2-4-17(19-12)21-11-16(20)18-8-13-5-14(9-18)7-15(6-13)10-18/h2-4,13-15H,5-11H2,1H3