2-azanyl-3-(2-oxidanidyl-2-oxidanylidene-ethyl)sulfanyl-propanoate; 2-methylsulfinylethylazanium

Systemtic Name: 2-azanyl-3-(2-oxidanidyl-2-oxidanylidene-ethyl)sulfanyl-propanoate; 2-methylsulfinylethylazanium Openeye Name: 2-amino-3-(2-oxido-2-oxo-ethyl)sulfanyl-propanoate; 2-methylsulfinylethylammonium CAS Name: 2-amino-3-[(2-oxido-2-oxoethyl)thio]propanoate; 2-methylsulfinylethylammonium IUPAC Name: 2-amino-3-(2-oxido-2-oxoethyl)sulfanylpropanoate; 2-methylsulfinylethylazanium Traditional Name: 2-amino-3-[(2-keto-2-oxido-ethyl)thio]propionate; 2-methylsulfinylethylammonium Formula: C11H27N3O6S3 MolecularWeight: 393.54358

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C5H9NO4S.2C3H9NOS/c6-3(5(9)10)1-11-2-4(7)8;2*1-6(5)3-2-4/h3H,1-2,6H2,(H,7,8)(H,9,10);2*2-4H2,1H3