lithium 2-[[3-(methylamino)-3-sulfanylidene-propyl]amino]ethylsulfanylphosphonic acid hydrate

Systemtic Name: lithium 2-[[3-(methylamino)-3-sulfanylidene-propyl]amino]ethylsulfanylphosphonic acid hydrate Openeye Name: lithium 2-[[3-(methylamino)-3-thioxo-propyl]amino]ethylsulfanylphosphonic acid hydrate CAS Name: lithium [2-[[3-(methylamino)-3-sulfanylidenepropyl]amino]ethylthio]phosphonic acid hydrate IUPAC Name: lithium 2-[[3-(methylamino)-3-sulfanylidenepropyl]amino]ethylsulfanylphosphonic acid hydrate Traditional Name: lithium [2-[[3-(methylamino)-3-thioxo-propyl]amino]ethylthio]phosphonic acid hydrate Formula: C6H17LiN2O4PS2+ MolecularWeight: 283.254941

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].CNC(=S)CCNCCSP(=O)(O)O.O

Isomeric SMILES

[Li+].CNC(=S)CCNCCSP(=O)(O)O.O

InChI

InChI=1S/C6H15N2O3PS2.Li.H2O/c1-7-6(13)2-3-8-4-5-14-12(9,10)11;;/h8H,2-5H2,1H3,(H,7,13)(H2,9,10,11);;1H2/q;+1;