Basic information
- Standard SMILES
CS(=O)(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc12- InChIKey
IURXOVLQTYZZIL-UHFFFAOYSA-N- Molecular formula
- C8H8N4O4S
- Average molar mass
- 256.24 g/mol
Names & identifiers
- Preferred name
- 3-methylsulfonylamino-5-nitro-1H-indazole
- IUPAC
- N-(5-nitro-1H-indazol-3-yl)methanesulfonamide
Names & synonyms
SCHEMBL4003944IURXOVLQTYZZIL-UHFFFAOYSA-NAKOS0335690633-methylsulfonylamino-5-nitro-1H-indazoleZ1729693222
Database identifiers
- PubChem CID
- 22567201
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 129 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 401
Related reactions
6 records
Compound notes
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