2H-Thieno(2,3-e)-1,2,4-thiadiazin-3(4H)-one, 4-methyl-2-(phenylmethyl)-, 1,1-dioxide
Basic information
- CAS
214916-47-9- Standard SMILES
CN1C(=O)N(Cc2ccccc2)S(=O)(=O)c2ccsc21- InChIKey
ZZTXSLQZLFPTIY-UHFFFAOYSA-N- Molecular formula
- C13H12N2O3S2
- Average molar mass
- 308.4 g/mol
- Monoisotopic mass
- 308.0289346
Names & identifiers
- Preferred name
- 2H-Thieno(2,3-e)-1,2,4-thiadiazin-3(4H)-one, 4-methyl-2-(phenylmethyl)-, 1,1-dioxide
- IUPAC
- 2-benzyl-4-methyl-1,1-dioxothieno[2,3-e][1,2,4]thiadiazin-3-one
Names & synonyms
214916-47-92H-Thieno(2,3-e)-1,2,4-thiadiazin-3(4H)-one, 4-methyl-2-(phenylmethyl)-, 1,1-dioxide4-Methyl-2-benzylthiopheno(2,3-e)1,2,4-thiadiazine-1,1,3-trione4-Methyl-2-benzylthiopheno[2,3-e]1,2,4-thiadiazine-1,1,3-trione2H-Thieno[2,3-e]-1,2,4-thiadiazin-3(4H)-one, 4-methyl-2-(phenylmethyl)-, 1,1-dioxideCHEMBL134035DTXSID501758132-benzyl-4-methyl-1,1-dioxo-thieno[2,3-e][1,2,4]thiadiazin-3-one2-Benzyl-4-methyl-1lambda~6~-thieno[2,3-e][1,2,4]thiadiazine-1,1,3(2H,4H)-trione
Database identifiers
- CAS
214916-47-9- PubChem CID
- 472033
- DTXSID
DTXSID50175813- ChEMBL
CHEMBL134035
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 94.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 482
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…