Basic information
- CAS
3735-61-3- Standard SMILES
N=C(N)Sc1cccc[n+]1[O-]- InChIKey
UQSKEICXKWTJDF-UHFFFAOYSA-N- Molecular formula
- C6H7N3OS
- Average molar mass
- 169.21 g/mol
- Monoisotopic mass
- 169.03098303
Names & identifiers
- Preferred name
- 2-Guanylmercaptopyridine 1-oxide
- IUPAC
- (1-oxidopyridin-1-ium-2-yl) carbamimidothioate
Names & synonyms
Omadine-thiourea2-Guanylmercaptopyridine 1-oxide2-Amidinothiopyridine N-oxide2-Pyridinyl carbamimidothioate N-oxide90737EZ78I2-(2-Pyridyl)-2-thiopseudourea N-oxideUNII-90737EZ78IPseudourea, 2-(2-pyridyl)-2-thio-, N-oxideCarbamimidothioic acid, 1-oxido-2-pyridinyl ester3735-61-3Q27271304
Database identifiers
- CAS
3735-61-3- PubChem CID
- 437587
- UNII
- 90737EZ78I
- Nikkaji
- J31.407B
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 153
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…