2,4-bis(phenylmethylsulfanyl)butanoic acid

Systemtic Name: 2,4-bis(phenylmethylsulfanyl)butanoic acid Openeye Name: 2,4-bis(benzylsulfanyl)butanoic acid CAS Name: 2,4-bis(phenylmethylthio)butanoic acid IUPAC Name: 2,4-bis(benzylsulfanyl)butanoic acid Traditional Name: 2,4-bis(benzylthio)butyric acid Formula: C18H20O2S2 MolecularWeight: 332.4802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCC(C(=O)O)SCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CSCCC(C(=O)O)SCC2=CC=CC=C2

InChI

InChI=1S/C18H20O2S2/c19-18(20)17(22-14-16-9-5-2-6-10-16)11-12-21-13-15-7-3-1-4-8-15/h1-10,17H,11-14H2,(H,19,20)