4-phenylsulfanyl-2-(2-phenylsulfanylethyl)butanoic acid

Systemtic Name: 4-phenylsulfanyl-2-(2-phenylsulfanylethyl)butanoic acid Openeye Name: 4-phenylsulfanyl-2-(2-phenylsulfanylethyl)butanoic acid CAS Name: 4-(phenylthio)-2-[2-(phenylthio)ethyl]butanoic acid IUPAC Name: 4-phenylsulfanyl-2-(2-phenylsulfanylethyl)butanoic acid Traditional Name: 4-(phenylthio)-2-[2-(phenylthio)ethyl]butyric acid Formula: C18H20O2S2 MolecularWeight: 332.4802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCC(CCSC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)SCCC(CCSC2=CC=CC=C2)C(=O)O

InChI

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