Basic information
- Standard SMILES
CCc1cc([N+](=O)[O-])cc(CC)c1NC(N)=S- InChIKey
GOWGIEZSTURGSZ-UHFFFAOYSA-N- Molecular formula
- C11H15N3O2S
- Average molar mass
- 253.32 g/mol
Names & identifiers
- Preferred name
- 2,6-Diethyl-4-nitrophenylthiourea
- IUPAC
- (2,6-diethyl-4-nitrophenyl)thiourea
Names & synonyms
SCHEMBL9616493GOWGIEZSTURGSZ-UHFFFAOYSA-N2,6-Diethyl-4-nitrophenylthiourea
Database identifiers
- PubChem CID
- 53849657
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 279
Related reactions
2 records
Compound notes
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