Basic information
- Standard SMILES
CCC(=O)c1[nH]c(-c2ccc(Cl)cc2)c(C)c1-c1ccc(S(N)(=O)=O)cc1- InChIKey
QEQXBTYYHGIUCK-UHFFFAOYSA-N- Molecular formula
- C20H19ClN2O3S
- Average molar mass
- 402.9 g/mol
Names & identifiers
- Preferred name
- 4-(5-(4-chlorophenyl)-4-methyl-2-propionyl-1H-pyrrol-3-yl)benzene sulfonamide
- IUPAC
- 4-[5-(4-chlorophenyl)-4-methyl-2-propanoyl-1H-pyrrol-3-yl]benzenesulfonamide
Names & synonyms
SCHEMBL12484073QEQXBTYYHGIUCK-UHFFFAOYSA-N4-(5-(4-chlorophenyl)-4-methyl-2-propionyl-1H-pyrrol-3-yl) benzene sulfonamide4-(5-(4-chlorophenyl)-4-methyl-2-propionyl-1H-pyrrol-3-yl)benzene sulfonamide
Database identifiers
- PubChem CID
- 60169353
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 620
Related reactions
2 records
Compound notes
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