3-azanyl-2-(phenylmethylsulfanyl)carbonylsulfanyl-propanoic acid

Systemtic Name: 3-azanyl-2-(phenylmethylsulfanyl)carbonylsulfanyl-propanoic acid Openeye Name: 3-amino-2-benzylsulfanylcarbonylsulfanyl-propanoic acid CAS Name: 3-amino-2-[[oxo-(phenylmethylthio)methyl]thio]propanoic acid IUPAC Name: 3-amino-2-benzylsulfanylcarbonylsulfanylpropanoic acid Traditional Name: 3-amino-2-[(benzylthio)carbonylthio]propionic acid Formula: C11H13NO3S2 MolecularWeight: 271.35582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC(=O)SC(CN)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CSC(=O)SC(CN)C(=O)O

InChI

InChI=1S/C11H13NO3S2/c12-6-9(10(13)14)17-11(15)16-7-8-4-2-1-3-5-8/h1-5,9H,6-7,12H2,(H,13,14)