Basic information
- Standard SMILES
CCc1cc(-c2ccc(S(=O)(=O)NCc3ccc(N(C)C)nc3)s2)c(C)[nH]c1=O.Cl- InChIKey
NTTGUVCDINVAKQ-UHFFFAOYSA-N- Molecular formula
- C20H25ClN4O3S2
- Average molar mass
- 469 g/mol
Names & identifiers
- Preferred name
- 5-(5-Ethyl-2-methyl-6-oxo-1,6-dihydropyridin-3-yl)thiophene-2-sulfonic acid [(6-dimethylaminopyridin-3-yl)methyl]amide hydrochloride
- IUPAC
- N-[[6-(dimethylamino)-3-pyridinyl]methyl]-5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)thiophene-2-sulfonamide;hydrochloride
Names & synonyms
SCHEMBL14142522NTTGUVCDINVAKQ-UHFFFAOYSA-N5-(5-Ethyl-2-methyl-6-oxo-1,6-dihydropyridin-3-yl)thiophene-2-sulfonic acid [(6-dimethylaminopyridin-3-yl)methyl]amide hydrochloride
Database identifiers
- PubChem CID
- 11634161
Properties
Computed structural properties
- Topological polar surface area
- 128 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 786
Related reactions
1 records
Compound notes
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