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

Systemtic Name: 2-ethyl-2-[[2-(phenylmethyl)phenyl]sulfanylmethyl]hexanal Openeye Name: 2-[(2-benzylphenyl)sulfanylmethyl]-2-ethyl-hexanal CAS Name: 2-ethyl-2-[[[2-(phenylmethyl)phenyl]thio]methyl]hexanal IUPAC Name: 2-[(2-benzylphenyl)sulfanylmethyl]-2-ethylhexanal Traditional Name: 2-[[(2-benzylphenyl)thio]methyl]-2-ethyl-hexanal Formula: C22H28OS MolecularWeight: 340.52212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)(CSC1=CC=CC=C1CC2=CC=CC=C2)C=O

Isomeric SMILES

CCCCC(CC)(CSC1=CC=CC=C1CC2=CC=CC=C2)C=O

InChI

InChI=1S/C22H28OS/c1-3-5-15-22(4-2,17-23)18-24-21-14-10-9-13-20(21)16-19-11-7-6-8-12-19/h6-14,17H,3-5,15-16,18H2,1-2H3