2-[[3-(methylamino)-3-oxidanylidene-propyl]amino]ethylsulfanylphosphonic acid

Systemtic Name: 2-[[3-(methylamino)-3-oxidanylidene-propyl]amino]ethylsulfanylphosphonic acid Openeye Name: 2-[[3-(methylamino)-3-oxo-propyl]amino]ethylsulfanylphosphonic acid CAS Name: [2-[[3-(methylamino)-3-oxopropyl]amino]ethylthio]phosphonic acid IUPAC Name: 2-[[3-(methylamino)-3-oxopropyl]amino]ethylsulfanylphosphonic acid Traditional Name: [2-[[3-keto-3-(methylamino)propyl]amino]ethylthio]phosphonic acid Formula: C6H15N2O4PS MolecularWeight: 242.233061

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CCNCCSP(=O)(O)O

Isomeric SMILES

CNC(=O)CCNCCSP(=O)(O)O

InChI

InChI=1S/C6H15N2O4PS/c1-7-6(9)2-3-8-4-5-14-13(10,11)12/h8H,2-5H2,1H3,(H,7,9)(H2,10,11,12)