Basic information
- Standard SMILES
N#Cc1ccc(N[C@H](Cc2cccs2)C(N)=O)cc1Br- InChIKey
CZZQVQVIVNYACV-CYBMUJFWSA-N- Molecular formula
- C14H12BrN3OS
- Average molar mass
- 350.24 g/mol
- Monoisotopic mass
- 348.98845
Names & identifiers
- Preferred name
- (R)-2-(3-bromo-4-cyanophenylamino)-3-(thiophen-2-yl)propanamide
- IUPAC
- (2R)-2-(3-bromo-4-cyanoanilino)-3-thiophen-2-ylpropanamide
Names & synonyms
SCHEMBL2712472CZZQVQVIVNYACV-CYBMUJFWSA-N(R)-2-(3-bromo-4-cyanophenylamino)-3-(thiophen-2-yl)propanamide
Database identifiers
- PubChem CID
- 67508155
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 397
Related reactions
4 records
Linked notes
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