(2S)-2-azaniumyl-4-(phenylmethylsulfanyl)butanoate

Systemtic Name: (2S)-2-azaniumyl-4-(phenylmethylsulfanyl)butanoate Openeye Name: (2S)-2-azaniumyl-4-benzylsulfanyl-butanoate CAS Name: (2S)-2-ammonio-4-(phenylmethylthio)butanoate IUPAC Name: (2S)-2-azaniumyl-4-benzylsulfanylbutanoate Traditional Name: (2S)-2-ammonio-4-(benzylthio)butyrate Formula: C11H15NO2S MolecularWeight: 225.3073

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15NO2S/c12-10(11(13)14)6-7-15-8-9-4-2-1-3-5-9/h1-5,10H,6-8,12H2,(H,13,14)/t10-/m0/s1