ethyl 1-[2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetyl]piperidine-4-carboxylate CAS Name: 1-[1-oxo-2-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]ethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[[4-(trifluoromethyl)pyrimidin-2-yl]thio]acetyl]isonipecotic acid ethyl ester Formula: C15H18F3N3O3S MolecularWeight: 377.38193

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CSC2=NC=CC(=N2)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CSC2=NC=CC(=N2)C(F)(F)F

InChI

InChI=1S/C15H18F3N3O3S/c1-2-24-13(23)10-4-7-21(8-5-10)12(22)9-25-14-19-6-3-11(20-14)15(16,17)18/h3,6,10H,2,4-5,7-9H2,1H3