Basic information
- CAS
56223-70-2- Standard SMILES
CCN(CC)CC.S=c1nc(-c2ccccc2)c(-c2ccccc2)n[nH]1- InChIKey
GYZIAUMBEMHOIG-UHFFFAOYSA-N- Molecular formula
- C21H26N4S
- Average molar mass
- 366.5 g/mol
- Monoisotopic mass
- 366.18781802
Names & identifiers
- Preferred name
- as-Triazine-3(2H)-thione, 5,6-diphenyl-, compd. with triethylamine
- IUPAC
- N,N-diethylethanamine;5,6-diphenyl-2H-1,2,4-triazine-3-thione
Names & synonyms
5,6-Diphenyl-as-triazine-3-thione triethylamine salt56223-70-2DTXSID00204783RefChem:320185DTXCID301272745,6-Diphenyl-1,2,4-triazine-3(2H)-thione--N,N-diethylethanamine (1/1)
Database identifiers
- CAS
56223-70-2- PubChem CID
- 3043868
- DTXSID
DTXSID00204783
Properties
Computed structural properties
- Topological polar surface area
- 72.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 427
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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