Basic information
- CAS
973-99-9- Standard SMILES
CCCSSC(CCO)=C(C)N(C=O)Cc1cnc(C)nc1N.Cl- InChIKey
DURRYBGTQKKQBR-UHFFFAOYSA-N- Molecular formula
- C15H25ClN4O2S2
- Average molar mass
- 393 g/mol
- Monoisotopic mass
- 392.1107461
Names & identifiers
- Preferred name
- N-[(4-amino-2-methylpyrimidin-5-yl)methyl]-N-[5-hydroxy-3-(propyldisulfanyl)pent-2-en-2-yl]formamide;hydrochloride
- IUPAC
- N-[(4-amino-2-methylpyrimidin-5-yl)methyl]-N-[5-hydroxy-3-(propyldisulfanyl)pent-2-en-2-yl]formamide;hydrochloride
Names & synonyms
DTXSID901366117NS00080133
Database identifiers
- CAS
973-99-9- PubChem CID
- 101930
- DTXSID
DTXSID901366117
Properties
Computed structural properties
- Topological polar surface area
- 143 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 396
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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