sodium 2-(2-sulfanylpropanoylamino)ethanoate hydrate

Systemtic Name: sodium 2-(2-sulfanylpropanoylamino)ethanoate hydrate Openeye Name: sodium 2-(2-sulfanylpropanoylamino)acetate hydrate CAS Name: sodium 2-[(2-mercapto-1-oxopropyl)amino]acetate hydrate IUPAC Name: sodium 2-(2-sulfanylpropanoylamino)acetate hydrate Traditional Name: sodium 2-(2-mercaptopropanoylamino)acetate hydrate Formula: C5H10NNaO4S MolecularWeight: 203.19197

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC(=O)[O-])S.O.[Na+]

Isomeric SMILES

CC(C(=O)NCC(=O)[O-])S.O.[Na+]

InChI

InChI=1S/C5H9NO3S.Na.H2O/c1-3(10)5(9)6-2-4(7)8;;/h3,10H,2H2,1H3,(H,6,9)(H,7,8);;1H2/q;+1;/p-1