Basic information
- CAS
97635-40-0- Standard SMILES
Nc1nc([S-])[nH]c(=O)c1N=O.[NH4+]- InChIKey
CABNQNSAWNPRJB-UHFFFAOYSA-N- Molecular formula
- C4H7N5O2S
- Average molar mass
- 189.2 g/mol
- Monoisotopic mass
- 189.03204566
Names & identifiers
- Preferred name
- 4-Amino-6-hydroxy-2-mercapto-5-nitrosopyrimidine ammonium salt
- IUPAC
- azanium 4-amino-5-nitroso-6-oxo-1H-pyrimidine-2-thiolate
Names & synonyms
4-Amino-6-hydroxy-2-mercapto-5-nitrosopyrimidine ammonium salt
Database identifiers
- CAS
97635-40-0- PubChem CID
- 175676415
- EC Number
- 226-680-0
Properties
Computed structural properties
- Topological polar surface area
- 98.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 282
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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