Basic information
- CAS
26690-91-5- Standard SMILES
Cc1c(NC(=O)c2cccs2)c(=O)n(-c2ccccc2)n1C- InChIKey
UUURGDJLVCIDOM-UHFFFAOYSA-N- Molecular formula
- C16H15N3O2S
- Average molar mass
- 313.4 g/mol
- Monoisotopic mass
- 313.0884979
Names & identifiers
- Preferred name
- 2-Thiophenecarboxamide, N-(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-
- IUPAC
- N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)thiophene-2-carboxamide
Names & synonyms
26690-91-52-Thiophenecarboxamide, N-(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-4-(2-Thiophenecarboxamido)antipyrineBRN 09300432-Thiophenecarboxamide, N-antipyrinyl-1'Amino-4-antipyrine avec 1'acide thiophene-carboxylique-2DTXSID40181201N-(2,3-Dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-2-thiophenecarboxamideRefChem:267337DTXCID10103692N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)thiophene-2-carboxamideF1142-2756
Show more names
N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-thiophenecarboxamideUUURGDJLVCIDOM-UHFFFAOYSA-NN-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)thiophene-2-carboxamideOprea1_106754Oprea1_713195MLS000686985CHEMBL1525006HMS2721M23
Database identifiers
- CAS
26690-91-5- PubChem CID
- 213545
- DTXSID
DTXSID40181201- ChEMBL
CHEMBL1525006
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 80.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 500
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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