Basic information
- CAS
69150-14-7- Standard SMILES
CCc1nc[nH]c1CSCCNC(=NC)NC#N- InChIKey
FBJNMWPBQKNDGC-UHFFFAOYSA-N- Molecular formula
- C11H18N6S
- Average molar mass
- 266.37 g/mol
- Monoisotopic mass
- 266.13136577
Names & identifiers
- Preferred name
- Guanidine, N-cyano-N'-(2-(((5-ethyl-1H-imidazol-4-yl)methyl)thio)ethyl)-N''-methyl-
- IUPAC
- 1-cyano-3-[2-[(4-ethyl-1H-imidazol-5-yl)methylsulfanyl]ethyl]-2-methylguanidine
Names & synonyms
69150-14-7Guanidine, N-cyano-N'-(2-(((5-ethyl-1H-imidazol-4-yl)methyl)thio)ethyl)-N''-methyl-SCHEMBL11366109SCHEMBL11366113SCHEMBL11366119DTXSID80988857N-Cyano-N'-(2-{[(4-ethyl-1H-imidazol-5-yl)methyl]sulfanyl}ethyl)-N''-methylguanidine
Database identifiers
- CAS
69150-14-7- PubChem CID
- 155253
- DTXSID
DTXSID80988857
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 310
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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