3-methyl-2-(2-methylphenyl)sulfanyl-cyclohexan-1-one

Systemtic Name: 3-methyl-2-(2-methylphenyl)sulfanyl-cyclohexan-1-one Openeye Name: 3-methyl-2-(o-tolylsulfanyl)cyclohexanone CAS Name: 3-methyl-2-[(2-methylphenyl)thio]-1-cyclohexanone IUPAC Name: 3-methyl-2-(2-methylphenyl)sulfanylcyclohexan-1-one Traditional Name: 3-methyl-2-(o-tolylthio)cyclohexanone Formula: C14H18OS MolecularWeight: 234.35712

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(=O)C1SC2=CC=CC=C2C

Isomeric SMILES

CC1CCCC(=O)C1SC2=CC=CC=C2C

InChI

InChI=1S/C14H18OS/c1-10-6-3-4-9-13(10)16-14-11(2)7-5-8-12(14)15/h3-4,6,9,11,14H,5,7-8H2,1-2H3