[2-(diethylcarbamothioylsulfanyl)ethyl-(2-hydroxyethyl)amino]phosphonic acid

Systemtic Name: [2-(diethylcarbamothioylsulfanyl)ethyl-(2-hydroxyethyl)amino]phosphonic acid Openeye Name: [2-(diethylcarbamothioylsulfanyl)ethyl-(2-hydroxyethyl)amino]phosphonic acid CAS Name: [2-[[diethylamino(sulfanylidene)methyl]thio]ethyl-(2-hydroxyethyl)amino]phosphonic acid IUPAC Name: [2-(diethylcarbamothioylsulfanyl)ethyl-(2-hydroxyethyl)amino]phosphonic acid Traditional Name: [2-(diethylthiocarbamoylthio)ethyl-(2-hydroxyethyl)amino]phosphonic acid Formula: C9H21N2O4PS2 MolecularWeight: 316.377801

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SCCN(CCO)P(=O)(O)O

Isomeric SMILES

CCN(CC)C(=S)SCCN(CCO)P(=O)(O)O

InChI

InChI=1S/C9H21N2O4PS2/c1-3-10(4-2)9(17)18-8-6-11(5-7-12)16(13,14)15/h12H,3-8H2,1-2H3,(H2,13,14,15)