(3S)-3-(2,4-dimethylphenyl)sulfanylcyclohexan-1-one

Systemtic Name: (3S)-3-(2,4-dimethylphenyl)sulfanylcyclohexan-1-one Openeye Name: (3S)-3-(2,4-dimethylphenyl)sulfanylcyclohexanone CAS Name: (3S)-3-[(2,4-dimethylphenyl)thio]-1-cyclohexanone IUPAC Name: (3S)-3-(2,4-dimethylphenyl)sulfanylcyclohexan-1-one Traditional Name: (3S)-3-[(2,4-dimethylphenyl)thio]cyclohexanone Formula: C14H18OS MolecularWeight: 234.35712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SC2CCCC(=O)C2)C

Isomeric SMILES

CC1=CC(=C(C=C1)S[C@H]2CCCC(=O)C2)C

InChI

InChI=1S/C14H18OS/c1-10-6-7-14(11(2)8-10)16-13-5-3-4-12(15)9-13/h6-8,13H,3-5,9H2,1-2H3/t13-/m0/s1