(2R)-2-acetamido-3-[(phenylmethyl)carbamothioylsulfanyl]propanoic acid

Systemtic Name: (2R)-2-acetamido-3-[(phenylmethyl)carbamothioylsulfanyl]propanoic acid Openeye Name: (2R)-2-acetamido-3-(benzylcarbamothioylsulfanyl)propanoic acid CAS Name: (2R)-2-acetamido-3-[[[(phenylmethyl)amino]-sulfanylidenemethyl]thio]propanoic acid IUPAC Name: (2R)-2-acetamido-3-(benzylcarbamothioylsulfanyl)propanoic acid Traditional Name: (2R)-2-acetamido-3-(benzylthiocarbamoylthio)propionic acid Formula: C13H16N2O3S2 MolecularWeight: 312.40774

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSC(=S)NCC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CC(=O)N[C@@H](CSC(=S)NCC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C13H16N2O3S2/c1-9(16)15-11(12(17)18)8-20-13(19)14-7-10-5-3-2-4-6-10/h2-6,11H,7-8H2,1H3,(H,14,19)(H,15,16)(H,17,18)/t11-/m0/s1