2-(phenylmethyl)-3-[2-(phenylmethylsulfanyl)ethylsulfanyl]propanoic acid

Systemtic Name: 2-(phenylmethyl)-3-[2-(phenylmethylsulfanyl)ethylsulfanyl]propanoic acid Openeye Name: 2-benzyl-3-(2-benzylsulfanylethylsulfanyl)propanoic acid CAS Name: 2-(phenylmethyl)-3-[2-(phenylmethylthio)ethylthio]propanoic acid IUPAC Name: 2-benzyl-3-(2-benzylsulfanylethylsulfanyl)propanoic acid Traditional Name: 2-benzyl-3-[2-(benzylthio)ethylthio]propionic acid Formula: C19H22O2S2 MolecularWeight: 346.50678

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CSCCSCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(CSCCSCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C19H22O2S2/c20-19(21)18(13-16-7-3-1-4-8-16)15-23-12-11-22-14-17-9-5-2-6-10-17/h1-10,18H,11-15H2,(H,20,21)