methyl 3,4-bis(phenylmethylsulfanyl)butanoate

Systemtic Name: methyl 3,4-bis(phenylmethylsulfanyl)butanoate Openeye Name: methyl 3,4-bis(benzylsulfanyl)butanoate CAS Name: 3,4-bis(phenylmethylthio)butanoic acid methyl ester IUPAC Name: methyl 3,4-bis(benzylsulfanyl)butanoate Traditional Name: 3,4-bis(benzylthio)butyric acid methyl ester Formula: C19H22O2S2 MolecularWeight: 346.50678

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CSCC1=CC=CC=C1)SCC2=CC=CC=C2

Isomeric SMILES

COC(=O)CC(CSCC1=CC=CC=C1)SCC2=CC=CC=C2

InChI

InChI=1S/C19H22O2S2/c1-21-19(20)12-18(23-14-17-10-6-3-7-11-17)15-22-13-16-8-4-2-5-9-16/h2-11,18H,12-15H2,1H3