2-(ethanoylsulfanylmethyl)-3-(phenylmethylsulfanyl)propanoic acid

Systemtic Name: 2-(ethanoylsulfanylmethyl)-3-(phenylmethylsulfanyl)propanoic acid Openeye Name: 2-(acetylsulfanylmethyl)-3-benzylsulfanyl-propanoic acid CAS Name: 2-[(acetylthio)methyl]-3-(phenylmethylthio)propanoic acid IUPAC Name: 2-(acetylsulfanylmethyl)-3-benzylsulfanylpropanoic acid Traditional Name: 2-[(acetylthio)methyl]-3-(benzylthio)propionic acid Formula: C13H16O3S2 MolecularWeight: 284.39434

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(CSCC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CC(=O)SCC(CSCC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C13H16O3S2/c1-10(14)18-9-12(13(15)16)8-17-7-11-5-3-2-4-6-11/h2-6,12H,7-9H2,1H3,(H,15,16)