Basic information
- Standard SMILES
CCCS(=O)c1ncn(C(=O)N(CC)CC)n1- InChIKey
CTBDDEQFJPLZDJ-UHFFFAOYSA-N- Molecular formula
- C10H18N4O2S
- Average molar mass
- 258.34 g/mol
Names & identifiers
- Preferred name
- 1-Diethylcarbamoyl-3-propylsulphinyl-1,2,4-triazole
- IUPAC
- N,N-diethyl-3-propylsulfinyl-1,2,4-triazole-1-carboxamide
Names & synonyms
SCHEMBL10506109CTBDDEQFJPLZDJ-UHFFFAOYSA-N1-diethylcarbamoyl-3-propylsulphinyl-1,2,4-triazole
Database identifiers
- PubChem CID
- 20163371
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 87.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 283
Related reactions
3 records
Compound notes
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