sodium [(2S)-2-azanyl-4-methylsulfanyl-1-oxidanyl-1-phosphono-butyl]-oxidanyl-phosphinate

Systemtic Name: sodium [(2S)-2-azanyl-4-methylsulfanyl-1-oxidanyl-1-phosphono-butyl]-oxidanyl-phosphinate Openeye Name: sodium [(2S)-2-amino-1-hydroxy-4-methylsulfanyl-1-phosphono-butyl]-hydroxy-phosphinate CAS Name: sodium [(2S)-2-amino-1-hydroxy-4-(methylthio)-1-phosphonobutyl]-hydroxyphosphinate IUPAC Name: sodium [(2S)-2-amino-1-hydroxy-4-methylsulfanyl-1-phosphonobutyl]-hydroxyphosphinate Traditional Name: sodium [(2S)-2-amino-1-hydroxy-4-(methylthio)-1-phosphono-butyl]-hydroxy-phosphinate Formula: C5H14NNaO7P2S MolecularWeight: 317.169452

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(O)(P(=O)(O)O)P(=O)(O)[O-])N.[Na+]

Isomeric SMILES

CSCC[C@@H](C(O)(P(=O)(O)O)P(=O)(O)[O-])N.[Na+]

InChI

InChI=1S/C5H15NO7P2S.Na/c1-16-3-2-4(6)5(7,14(8,9)10)15(11,12)13;/h4,7H,2-3,6H2,1H3,(H2,8,9,10)(H2,11,12,13);/q;+1/p-1/t4-;/m0./s1