[2-hexylsulfanyl-1-methyl-5-(methylcarbamoyloxymethyl)imidazol-4-yl]methyl N-methylcarbamate;hydrochloride
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Basic information
- Standard SMILES
CCCCCCSc1nc(COC(=O)NC)c(COC(=O)NC)n1C.Cl- InChIKey
LZWBLRLFWPMOSM-UHFFFAOYSA-N- Molecular formula
- C16H29ClN4O4S
- Average molar mass
- 408.9 g/mol
- Monoisotopic mass
- 408.1598043
Names & identifiers
- Preferred name
- [2-hexylsulfanyl-1-methyl-5-(methylcarbamoyloxymethyl)imidazol-4-yl]methyl N-methylcarbamate;hydrochloride
- IUPAC
- [2-hexylsulfanyl-1-methyl-5-(methylcarbamoyloxymethyl)imidazol-4-yl]methyl N-methylcarbamate;hydrochloride
Names & synonyms
NSC608626CHEMBL1975904NSC-608626
Database identifiers
- PubChem CID
- 355287
- ChEMBL
CHEMBL1975904
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 120 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 12
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 414
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Compound notes
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