Basic information
- Standard SMILES
CSc1sc(C(N)=O)cc1S(=O)(=O)c1ccc(N)c(Br)c1- InChIKey
WZUOLIBKXFBRJX-UHFFFAOYSA-N- Molecular formula
- C12H11BrN2O3S3
- Average molar mass
- 407.3 g/mol
Names & identifiers
- Preferred name
- 4-(4-Amino-3-bromo-benzenesulfonyl)-5-methylsulfanyl-thiophene-2-carboxylic acid amide
- IUPAC
- 4-(4-amino-3-bromophenyl)sulfonyl-5-methylsulfanylthiophene-2-carboxamide
Names & synonyms
SCHEMBL5840435WZUOLIBKXFBRJX-UHFFFAOYSA-N4-(4-Amino-3-bromo-benzenesulfonyl)-5-methylsulfanyl-thiophene-2-carboxylic acid amide
Database identifiers
- PubChem CID
- 69586486
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 165 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 496
Related reactions
4 records
Compound notes
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