3-(2-phenylsulfanylpropan-2-yl)cyclohexan-1-one

Systemtic Name: 3-(2-phenylsulfanylpropan-2-yl)cyclohexan-1-one Openeye Name: 3-(1-methyl-1-phenylsulfanyl-ethyl)cyclohexanone CAS Name: 3-[2-(phenylthio)propan-2-yl]-1-cyclohexanone IUPAC Name: 3-(2-phenylsulfanylpropan-2-yl)cyclohexan-1-one Traditional Name: 3-[1-methyl-1-(phenylthio)ethyl]cyclohexanone Formula: C15H20OS MolecularWeight: 248.3837

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1CCCC(=O)C1)SC2=CC=CC=C2

Isomeric SMILES

CC(C)(C1CCCC(=O)C1)SC2=CC=CC=C2

InChI

InChI=1S/C15H20OS/c1-15(2,12-7-6-8-13(16)11-12)17-14-9-4-3-5-10-14/h3-5,9-10,12H,6-8,11H2,1-2H3