(3R)-1-[4-(1-ethylpyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]piperidine-3-carboxylate

Systemtic Name: (3R)-1-[4-(1-ethylpyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]piperidine-3-carboxylate Openeye Name: (3R)-1-[4-(1-ethylpyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]piperidine-3-carboxylate CAS Name: (3R)-1-[4-(1-ethyl-4-pyrazolyl)-6-(trifluoromethyl)-2-pyrimidinyl]-3-piperidinecarboxylate IUPAC Name: (3R)-1-[4-(1-ethylpyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]piperidine-3-carboxylate Traditional Name: (3R)-1-[4-(1-ethylpyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]nipecotate Formula: C16H17F3N5O2- MolecularWeight: 368.33369

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)C2=CC(=NC(=N2)N3CCCC(C3)C(=O)[O-])C(F)(F)F

Isomeric SMILES

CCN1C=C(C=N1)C2=CC(=NC(=N2)N3CCC[C@H](C3)C(=O)[O-])C(F)(F)F

InChI

InChI=1S/C16H18F3N5O2/c1-2-24-9-11(7-20-24)12-6-13(16(17,18)19)22-15(21-12)23-5-3-4-10(8-23)14(25)26/h6-7,9-10H,2-5,8H2,1H3,(H,25,26)/p-1/t10-/m1/s1