1-[(2R)-2-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[(2R)-2-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanoyl]piperidine-4-carboxamide Openeye Name: 1-[(2R)-2-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanoyl]piperidine-4-carboxamide CAS Name: 1-[(2R)-1-oxo-2-[[4-phenyl-6-(trifluoromethyl)-2-pyrimidinyl]thio]propyl]-4-piperidinecarboxamide IUPAC Name: 1-[(2R)-2-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanoyl]piperidine-4-carboxamide Traditional Name: 1-[(2R)-2-[[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]thio]propanoyl]isonipecotamide Formula: C20H21F3N4O2S MolecularWeight: 438.46655

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(CC1)C(=O)N)SC2=NC(=CC(=N2)C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)N1CCC(CC1)C(=O)N)SC2=NC(=CC(=N2)C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C20H21F3N4O2S/c1-12(18(29)27-9-7-14(8-10-27)17(24)28)30-19-25-15(13-5-3-2-4-6-13)11-16(26-19)20(21,22)23/h2-6,11-12,14H,7-10H2,1H3,(H2,24,28)/t12-/m1/s1