1-cyclohexyl-3-(2-methylsulfanylphenyl)propan-1-one

Systemtic Name: 1-cyclohexyl-3-(2-methylsulfanylphenyl)propan-1-one Openeye Name: 1-cyclohexyl-3-(2-methylsulfanylphenyl)propan-1-one CAS Name: 1-cyclohexyl-3-[2-(methylthio)phenyl]-1-propanone IUPAC Name: 1-cyclohexyl-3-(2-methylsulfanylphenyl)propan-1-one Traditional Name: 1-cyclohexyl-3-[2-(methylthio)phenyl]propan-1-one Formula: C16H22OS MolecularWeight: 262.41028

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1CCC(=O)C2CCCCC2

Isomeric SMILES

CSC1=CC=CC=C1CCC(=O)C2CCCCC2

InChI

InChI=1S/C16H22OS/c1-18-16-10-6-5-9-14(16)11-12-15(17)13-7-3-2-4-8-13/h5-6,9-10,13H,2-4,7-8,11-12H2,1H3