propanamide, n-methyl-3-((2-phosphonothio)ethyl)amino-, monolithium salt
Basic information
- CAS
127914-17-4- Standard SMILES
CNC(=O)CCNCCSP(=O)([O-])O.[Li+]- InChIKey
UIYLFWIZJDCOIV-UHFFFAOYSA-M- Molecular formula
- C6H14LiN2O4PS
- Average molar mass
- 248.2 g/mol
- Monoisotopic mass
- 248.05719354
Names & identifiers
- Preferred name
- propanamide, n-methyl-3-((2-phosphonothio)ethyl)amino-, monolithium salt
- IUPAC
- lithium hydroxy-[2-[[3-(methylamino)-3-oxopropyl]amino]ethylsulfanyl]phosphinate
Names & synonyms
Propanamide, N-methyl-3-((2-phosphonothio)ethyl)amino-, monolithium saltN-Methyl-3-((2-phosphonothio)ethyl)aminopropanamide monolithium salt127914-17-4S-(2-((2'-(N-Methylcarbamoyl)ethyl)amino)ethyl) lithium hydrogen phosphorothioateDTXSID20155723RefChem:374244DTXCID3078214CHEMBL81894Lithium N~3~-{2-[(hydroxyphosphinato)sulfanyl]ethyl}-N-methyl-beta-alaninamide
Database identifiers
- CAS
127914-17-4- PubChem CID
- 23693545
- DTXSID
DTXSID20155723- ChEMBL
CHEMBL81894
Properties
Computed structural properties
- Topological polar surface area
- 127 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 231
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Related reactions
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Compound notes
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