2H-Thieno(3,4-e)-1,2,4-thiadiazin-3(4H)-one, 4-((3-chlorophenyl)methyl)-2-(phenylmethyl)-, 1,1-dioxide
Basic information
- CAS
214916-27-5- Standard SMILES
O=C1N(Cc2cccc(Cl)c2)c2cscc2S(=O)(=O)N1Cc1ccccc1- InChIKey
UTUNXHDUZCLGPJ-UHFFFAOYSA-N- Molecular formula
- C19H15ClN2O3S2
- Average molar mass
- 418.9 g/mol
- Monoisotopic mass
- 418.0212624
Names & identifiers
- Preferred name
- 2H-Thieno(3,4-e)-1,2,4-thiadiazin-3(4H)-one, 4-((3-chlorophenyl)methyl)-2-(phenylmethyl)-, 1,1-dioxide
- IUPAC
- 2-benzyl-4-[(3-chlorophenyl)methyl]-1,1-dioxothieno[3,4-e][1,2,4]thiadiazin-3-one
Names & synonyms
214916-27-52H-Thieno(3,4-e)-1,2,4-thiadiazin-3(4H)-one, 4-((3-chlorophenyl)methyl)-2-(phenylmethyl)-, 1,1-dioxide4-((3-Chlorophenyl)methyl)-2-benzylthiopheno(3,4-e)1,2,4-thiadiazaperhydroine-1,1,3-trione2H-Thieno[3,4-e]-1,2,4-thiadiazin-3(4H)-one, 4-[(3-chlorophenyl)methyl]-2-(phenylmethyl)-, 1,1-dioxide4-[(3-Chlorophenyl)methyl]-2-benzylthiopheno[3,4-e]1,2,4-thiadiazaperhydroine-1,1,3-trioneCHEMBL132556DTXSID701757942-benzyl-4-[(3-chlorophenyl)methyl]-1,1-dioxo-thieno[3,4-e][1,2,4]thiadiazin-3-one2-Benzyl-4-[(3-chlorophenyl)methyl]-1lambda~6~-thieno[3,4-e][1,2,4]thiadiazine-1,1,3(2H,4H)-trione
Database identifiers
- CAS
214916-27-5- PubChem CID
- 472013
- DTXSID
DTXSID70175794- ChEMBL
CHEMBL132556
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 94.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 648
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…