Basic information
- Standard SMILES
Cc1nc(NC2CC2)sc1C(=O)NC(C#N)c1cccs1- InChIKey
UQPQBXCTUZJDLA-UHFFFAOYSA-N- Molecular formula
- C14H14N4OS2
- Average molar mass
- 318.4 g/mol
- Monoisotopic mass
- 318.06090343
Names & identifiers
- Preferred name
- 2-Cyclopropylamino-4-methyl-thiazole-5-carboxylic acid (cyano-thiophen-2-yl-methyl)-amide
- IUPAC
- N-[cyano(thiophen-2-yl)methyl]-2-(cyclopropylamino)-4-methyl-1,3-thiazole-5-carboxamide
Names & synonyms
UQPQBXCTUZJDLA-UHFFFAOYSA-N2-cyclopropylamino-4-methyl-thiazole-5-carboxylic acid (cyano-thiophen-2-yl-methyl)-amide
Database identifiers
- PubChem CID
- 54367202
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 134 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 448
Related reactions
4 records
Compound notes
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