2-(2,2-diphosphonatoethylamino)ethanethiol

Systemtic Name: 2-(2,2-diphosphonatoethylamino)ethanethiol Openeye Name: 2-(2,2-diphosphonatoethylamino)ethanethiol CAS Name: 2-(2,2-diphosphonatoethylamino)ethanethiol IUPAC Name: 2-(2,2-diphosphonatoethylamino)ethanethiol Traditional Name: 2-(2,2-diphosphonatoethylamino)ethanethiol Formula: C4H9NO6P2S-4 MolecularWeight: 261.129882

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Descriptors Computed from Structure

Canonical SMILES:

C(CS)NCC(P(=O)([O-])[O-])P(=O)([O-])[O-]

Isomeric SMILES

C(CS)NCC(P(=O)([O-])[O-])P(=O)([O-])[O-]

InChI

InChI=1S/C4H13NO6P2S/c6-12(7,8)4(13(9,10)11)3-5-1-2-14/h4-5,14H,1-3H2,(H2,6,7,8)(H2,9,10,11)/p-4