2-[3-(phenylcarbonylsulfanyl)propanoylamino]-3-sulfanyl-propanoic acid

Systemtic Name: 2-[3-(phenylcarbonylsulfanyl)propanoylamino]-3-sulfanyl-propanoic acid Openeye Name: 2-(3-benzoylsulfanylpropanoylamino)-3-sulfanyl-propanoic acid CAS Name: 2-[[3-(benzoylthio)-1-oxopropyl]amino]-3-mercaptopropanoic acid IUPAC Name: 2-(3-benzoylsulfanylpropanoylamino)-3-sulfanylpropanoic acid Traditional Name: 2-[3-(benzoylthio)propanoylamino]-3-mercapto-propionic acid Formula: C13H15NO4S2 MolecularWeight: 313.3925

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)SCCC(=O)NC(CS)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)SCCC(=O)NC(CS)C(=O)O

InChI

InChI=1S/C13H15NO4S2/c15-11(14-10(8-19)12(16)17)6-7-20-13(18)9-4-2-1-3-5-9/h1-5,10,19H,6-8H2,(H,14,15)(H,16,17)