(2S)-2-azaniumyl-3-methylsulfonylsulfanyl-propanoate

Systemtic Name: (2S)-2-azaniumyl-3-methylsulfonylsulfanyl-propanoate Openeye Name: (2S)-2-azaniumyl-3-methylsulfonylsulfanyl-propanoate CAS Name: (2S)-2-ammonio-3-(methylsulfonylthio)propanoate IUPAC Name: (2S)-2-azaniumyl-3-methylsulfonylsulfanylpropanoate Traditional Name: (2S)-2-ammonio-3-(mesylthio)propionate Formula: C4H9NO4S2 MolecularWeight: 199.24856

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)SCC(C(=O)[O-])[NH3+]

Isomeric SMILES

CS(=O)(=O)SC[C@H](C(=O)[O-])[NH3+]

InChI

InChI=1S/C4H9NO4S2/c1-11(8,9)10-2-3(5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-/m1/s1