6-(3,4-dimethylphenyl)sulfanylhexan-2-one

Systemtic Name: 6-(3,4-dimethylphenyl)sulfanylhexan-2-one Openeye Name: 6-(3,4-dimethylphenyl)sulfanylhexan-2-one CAS Name: 6-[(3,4-dimethylphenyl)thio]-2-hexanone IUPAC Name: 6-(3,4-dimethylphenyl)sulfanylhexan-2-one Traditional Name: 6-[(3,4-dimethylphenyl)thio]hexan-2-one Formula: C14H20OS MolecularWeight: 236.373

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCCCC(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCCCCC(=O)C)C

InChI

InChI=1S/C14H20OS/c1-11-7-8-14(10-12(11)2)16-9-5-4-6-13(3)15/h7-8,10H,4-6,9H2,1-3H3