1-phenylmethoxy-3-[(phenylmethylsulfanyl)methyl]hexan-2-one

Systemtic Name: 1-phenylmethoxy-3-[(phenylmethylsulfanyl)methyl]hexan-2-one Openeye Name: 1-benzyloxy-3-(benzylsulfanylmethyl)hexan-2-one CAS Name: 1-phenylmethoxy-3-[(phenylmethylthio)methyl]-2-hexanone IUPAC Name: 3-(benzylsulfanylmethyl)-1-phenylmethoxyhexan-2-one Traditional Name: 1-benzoxy-3-[(benzylthio)methyl]hexan-2-one Formula: C21H26O2S MolecularWeight: 342.49494

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CSCC1=CC=CC=C1)C(=O)COCC2=CC=CC=C2

Isomeric SMILES

CCCC(CSCC1=CC=CC=C1)C(=O)COCC2=CC=CC=C2

InChI

InChI=1S/C21H26O2S/c1-2-9-20(17-24-16-19-12-7-4-8-13-19)21(22)15-23-14-18-10-5-3-6-11-18/h3-8,10-13,20H,2,9,14-17H2,1H3