2-ethyl-2-[[2-(phenylcarbonyl)phenyl]sulfanylmethyl]hexanal

Systemtic Name: 2-ethyl-2-[[2-(phenylcarbonyl)phenyl]sulfanylmethyl]hexanal Openeye Name: 2-[(2-benzoylphenyl)sulfanylmethyl]-2-ethyl-hexanal CAS Name: 2-[[(2-benzoylphenyl)thio]methyl]-2-ethylhexanal IUPAC Name: 2-[(2-benzoylphenyl)sulfanylmethyl]-2-ethylhexanal Traditional Name: 2-[[(2-benzoylphenyl)thio]methyl]-2-ethyl-hexanal Formula: C22H26O2S MolecularWeight: 354.50564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)(CSC1=CC=CC=C1C(=O)C2=CC=CC=C2)C=O

Isomeric SMILES

CCCCC(CC)(CSC1=CC=CC=C1C(=O)C2=CC=CC=C2)C=O

InChI

InChI=1S/C22H26O2S/c1-3-5-15-22(4-2,16-23)17-25-20-14-10-9-13-19(20)21(24)18-11-7-6-8-12-18/h6-14,16H,3-5,15,17H2,1-2H3