Basic information
- CAS
55864-41-0- Standard SMILES
CS(=O)(=O)c1noc(N)n1- InChIKey
YYYSOQGDCICFGU-UHFFFAOYSA-N- Molecular formula
- C3H5N3O3S
- Average molar mass
- 163.16 g/mol
- Monoisotopic mass
- 163.0051622
Names & identifiers
- Preferred name
- 3-(Methylsulfonyl)-1,2,4-oxadiazol-5(2H)-imine
- IUPAC
- 3-methylsulfonyl-1,2,4-oxadiazol-5-amine
Names & synonyms
55864-41-03-(Methylsulfonyl)-1,2,4-oxadiazol-5(2H)-imineD7JS0NOE7RUNII-D7JS0NOE7RNSC 344508NSC-344508DTXSID202044621,2,4-OXADIAZOL-5-AMINE, 3-(METHYLSULFONYL)-RefChem:92678DTXCID201269533-(Methylsulfonyl)-1,2,4-oxadiazol-5-amineNSC344508
Show more names
3-(Methanesulfonyl)-1,2,4-oxadiazol-5-amine3-methylsulfonyl-2H-1,2,4-oxadiazol-5-imine
Database identifiers
- CAS
55864-41-0- PubChem CID
- 335396
- DTXSID
DTXSID20204462- UNII
- D7JS0NOE7R
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 208
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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