N-acetyl-2-{2-[2-(4-(3-fluorophenyl)-1,2,3,6-tetrahydropyridin-1-yl)ethyloxy]phenyl}thiazolidine-3-carbothioamide
Basic information
- Standard SMILES
CC(=O)NC(=S)N1CCSC1c1ccccc1OCCN1CC=C(c2cccc(F)c2)CC1- InChIKey
DZBMZIQBQWTTSK-UHFFFAOYSA-N- Molecular formula
- C25H28FN3O2S2
- Average molar mass
- 485.6 g/mol
- Monoisotopic mass
- 485.16069765
Names & identifiers
- Preferred name
- N-acetyl-2-{2-[2-(4-(3-fluorophenyl)-1,2,3,6-tetrahydropyridin-1-yl)ethyloxy]phenyl}thiazolidine-3-carbothioamide
- IUPAC
- N-[2-[2-[2-[4-(3-fluorophenyl)-3,6-dihydro-2H-pyridin-1-yl]ethoxy]phenyl]-1,3-thiazolidine-3-carbothioyl]acetamide
Names & synonyms
SCHEMBL10365764DZBMZIQBQWTTSK-UHFFFAOYSA-NN-acetyl-2-{2-[2-(4-(3-fluorophenyl)-1,2,3,6-tetrahydropyridin-1-yl)ethyloxy]phenyl}thiazolidine-3-carbothioamide
Database identifiers
- PubChem CID
- 13749596
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 722
Related reactions
1 records
Compound notes
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