(2S)-2-azaniumyl-3-(pyridin-3-ylmethylsulfanyl)propanoate

Systemtic Name: (2S)-2-azaniumyl-3-(pyridin-3-ylmethylsulfanyl)propanoate Openeye Name: (2S)-2-azaniumyl-3-(3-pyridylmethylsulfanyl)propanoate CAS Name: (2S)-2-ammonio-3-(3-pyridinylmethylthio)propanoate IUPAC Name: (2S)-2-azaniumyl-3-(pyridin-3-ylmethylsulfanyl)propanoate Traditional Name: (2S)-2-ammonio-3-(3-pyridylmethylthio)propionate Formula: C9H12N2O2S MolecularWeight: 212.26878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H12N2O2S/c10-8(9(12)13)6-14-5-7-2-1-3-11-4-7/h1-4,8H,5-6,10H2,(H,12,13)/t8-/m1/s1