Basic information
- CAS
505058-45-7- Standard SMILES
CCCNC(=O)CSc1nc(-c2ccco2)cc(C(F)(F)F)n1- InChIKey
DDVPEPNXLXQFKR-UHFFFAOYSA-N- Molecular formula
- C14H14F3N3O2S
- Average molar mass
- 345.34 g/mol
Names & identifiers
- Preferred name
- 2-{[4-(2-furyl)-6-(trifluoromethyl)-2-pyrimidinyl]sulfanyl}-N-propylacetamide
- IUPAC
- 2-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-propylacetamide
- English name
- 2-{[4-(2-furyl)-6-(trifluoromethyl)-2-pyrimidinyl]sulfanyl}-N-propylacetamide
- Molecular formula
- C14H14F3N3O2S
- Molecular weight
- 345.3400696
Names & synonyms
2-{[4-(2-furyl)-6-(trifluoromethyl)-2-pyrimidinyl]sulfanyl}-N-propylacetamideBAS 03153818STK339058AKOS0005572362-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-propylacetamideST50270358AN-329/42285397SR-01000357631SR-01000357631-12-[4-(2-furyl)-6-(trifluoromethyl)pyrimidin-2-ylthio]-N-propylacetamide2-{[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}-N-propylacetamide
Database identifiers
- CAS
505058-45-7
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 93.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 398
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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