(phenylmethylsulfanyl) 2-methyl-5-[4-methyl-5-oxidanylidene-5-(phenylmethylsulfanyl)oxy-pentyl]sulfanyl-pentanoate

Systemtic Name: (phenylmethylsulfanyl) 2-methyl-5-[4-methyl-5-oxidanylidene-5-(phenylmethylsulfanyl)oxy-pentyl]sulfanyl-pentanoate Openeye Name: benzylsulfanyl 5-(5-benzylsulfanyloxy-4-methyl-5-oxo-pentyl)sulfanyl-2-methyl-pentanoate CAS Name: 2-methyl-5-[[4-methyl-5-oxo-5-(phenylmethylthio)oxypentyl]thio]pentanoic acid (phenylmethylthio) ester IUPAC Name: benzylsulfanyl 5-(5-benzylsulfanyloxy-4-methyl-5-oxopentyl)sulfanyl-2-methylpentanoate Traditional Name: 5-[[5-(benzylthio)oxy-5-keto-4-methyl-pentyl]thio]-2-methyl-valeric acid (benzylthio) ester Formula: C26H34O4S3 MolecularWeight: 506.74076

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCSCCCC(C)C(=O)OSCC1=CC=CC=C1)C(=O)OSCC2=CC=CC=C2

Isomeric SMILES

CC(CCCSCCCC(C)C(=O)OSCC1=CC=CC=C1)C(=O)OSCC2=CC=CC=C2

InChI

InChI=1S/C26H34O4S3/c1-21(25(27)29-32-19-23-13-5-3-6-14-23)11-9-17-31-18-10-12-22(2)26(28)30-33-20-24-15-7-4-8-16-24/h3-8,13-16,21-22H,9-12,17-20H2,1-2H3