Basic information
- Standard SMILES
CC(C)=CCNC(=O)N1CC(=O)SC1=O- InChIKey
GJUAKNCKYYVXNY-UHFFFAOYSA-N- Molecular formula
- C9H12N2O3S
- Average molar mass
- 228.27 g/mol
- Monoisotopic mass
- 228.05686342
Names & identifiers
- Preferred name
- 3-(3-Methyl-but-2-en-1-yl)aminocarbonyl-2,5-thiazolidinedione
- IUPAC
- N-(3-methylbut-2-enyl)-2,5-dioxo-1,3-thiazolidine-3-carboxamide
Names & synonyms
SCHEMBL6178377GJUAKNCKYYVXNY-UHFFFAOYSA-N3-(3-methyl-but-2-en-1-yl)aminocarbonyl-2,5-thiazolidinedione
Database identifiers
- PubChem CID
- 69693175
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 91.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 334
Related reactions
2 records
Compound notes
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