Basic information
- CAS
37864-85-0- Standard SMILES
Cc1nsc(S(C)(=O)=O)n1- InChIKey
VCYNNXYLNYDHMT-UHFFFAOYSA-N- Molecular formula
- C4H6N2O2S2
- Average molar mass
- 178.2 g/mol
- Monoisotopic mass
- 177.98706979
Names & identifiers
- Preferred name
- 3-Methyl-5-methylsulfonyl-1,2,4-thiadiazole
- IUPAC
- 3-methyl-5-methylsulfonyl-1,2,4-thiadiazole
Names & synonyms
3-methyl-5-methylsulfonyl-1,2,4-thiadiazole37864-85-03-methyl-5-(methylsulfonyl)-1,2,4-thiadiazole1,2,4-Thiadiazole, 3-methyl-5-(methylsulfonyl)-SCHEMBL6425566DTXSID70958903DB-2181465-(Methanesulfonyl)-3-methyl-1,2,4-thiadiazole
Database identifiers
- CAS
37864-85-0- PubChem CID
- 181553
- DTXSID
DTXSID70958903
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 96.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- 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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