2-[[(2R)-2-azaniumyl-3-(phenylmethylsulfanyl)propanoyl]amino]ethanoate

Systemtic Name: 2-[[(2R)-2-azaniumyl-3-(phenylmethylsulfanyl)propanoyl]amino]ethanoate Openeye Name: 2-[[(2R)-2-azaniumyl-3-benzylsulfanyl-propanoyl]amino]acetate CAS Name: 2-[[(2R)-2-ammonio-1-oxo-3-(phenylmethylthio)propyl]amino]acetate IUPAC Name: 2-[[(2R)-2-azaniumyl-3-benzylsulfanylpropanoyl]amino]acetate Traditional Name: 2-[[(2R)-2-ammonio-3-(benzylthio)propanoyl]amino]acetate Formula: C12H16N2O3S MolecularWeight: 268.33204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC(C(=O)NCC(=O)[O-])[NH3+]

Isomeric SMILES

C1=CC=C(C=C1)CSC[C@@H](C(=O)NCC(=O)[O-])[NH3+]

InChI

InChI=1S/C12H16N2O3S/c13-10(12(17)14-6-11(15)16)8-18-7-9-4-2-1-3-5-9/h1-5,10H,6-8,13H2,(H,14,17)(H,15,16)/t10-/m0/s1