Basic information
- CAS
56223-71-3- Standard SMILES
C1CCNCC1.S=c1nc(-c2ccccc2)c(-c2ccccc2)n[nH]1- InChIKey
HBOPTZZNKPTGAI-UHFFFAOYSA-N- Molecular formula
- C20H22N4S
- Average molar mass
- 350.5 g/mol
- Monoisotopic mass
- 350.15651789
Names & identifiers
- Preferred name
- as-Triazine-3(2H)-thione, 5,6-diphenyl-, compd. with piperidine
- IUPAC
- 5,6-diphenyl-2H-1,2,4-triazine-3-thione;piperidine
Names & synonyms
5,6-Diphenyl-as-triazine-3-thione piperidine salt56223-71-3DTXSID60204784RefChem:320184DTXCID901272755,6-Diphenyl-1,2,4-triazine-3(2H)-thione--piperidine (1/1)
Database identifiers
- CAS
56223-71-3- PubChem CID
- 3043869
- DTXSID
DTXSID60204784
Properties
Computed structural properties
- Topological polar surface area
- 80.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 433
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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