1-(1-adamantyl)-2-(4-methylphenyl)sulfanyl-ethanone

Systemtic Name: 1-(1-adamantyl)-2-(4-methylphenyl)sulfanyl-ethanone Openeye Name: 1-(1-adamantyl)-2-(p-tolylsulfanyl)ethanone CAS Name: 1-(1-adamantyl)-2-[(4-methylphenyl)thio]ethanone IUPAC Name: 1-(1-adamantyl)-2-(4-methylphenyl)sulfanylethanone Traditional Name: 1-(1-adamantyl)-2-(p-tolylthio)ethanone Formula: C19H24OS MolecularWeight: 300.45826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24OS/c1-13-2-4-17(5-3-13)21-12-18(20)19-9-14-6-15(10-19)8-16(7-14)11-19/h2-5,14-16H,6-12H2,1H3