Basic information
- Standard SMILES
Cc1sc(NC(=O)NC(=O)c2ccccc2)c(C#N)c1C- InChIKey
BVVMHPKKMQJTQP-UHFFFAOYSA-N- Molecular formula
- C15H13N3O2S
- Average molar mass
- 299.3 g/mol
Names & identifiers
- Preferred name
- N-(3-cyano-4,5-dimethylthiophen-2-ylcarbamoyl)benzamide
- IUPAC
- N-[(3-cyano-4,5-dimethylthiophen-2-yl)carbamoyl]benzamide
Names & synonyms
N-((3-Cyano-4,5-dimethylthiophen-2-yl)carbamoyl)benzamide1092080-02-8SCHEMBL1622707BVVMHPKKMQJTQP-UHFFFAOYSA-NN-(3-cyano-4,5-dimethylthiophen-2-ylcarbamoyl)benzamide
Database identifiers
- PubChem CID
- 57456902
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 453
Related reactions
15 records
Compound notes
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