3-Ethoxy-4,5-dihydro-4-methyl-N-[[2-[(1-methylethyl)amino]phenyl]sulfonyl]-5-oxo-1H-1,2,4-triazole-1-carboxamide
Basic information
- CAS
196965-15-8- Standard SMILES
CCOc1nn(C(=O)NS(=O)(=O)c2ccccc2NC(C)C)c(=O)n1C- InChIKey
SAOZRKNDWGGQQI-UHFFFAOYSA-N- Molecular formula
- C15H21N5O5S
- Average molar mass
- 383.4 g/mol
- Monoisotopic mass
- 383.12633996
Names & identifiers
- Preferred name
- 3-Ethoxy-4,5-dihydro-4-methyl-N-[[2-[(1-methylethyl)amino]phenyl]sulfonyl]-5-oxo-1H-1,2,4-triazole-1-carboxamide
- IUPAC
- 3-ethoxy-4-methyl-5-oxo-N-[2-(propan-2-ylamino)phenyl]sulfonyl-1,2,4-triazole-1-carboxamide
Names & synonyms
DTXSID401107697196965-15-83-Ethoxy-4,5-dihydro-4-methyl-N-[[2-[(1-methylethyl)amino]phenyl]sulfonyl]-5-oxo-1H-1,2,4-triazole-1-carboxamide
Database identifiers
- CAS
196965-15-8- PubChem CID
- 165367335
- DTXSID
DTXSID401107697
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 129 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 672
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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