N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-ium-4-yl]-2-methyl-propyl]-3-[5,7-dimethyl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide

Systemtic Name: N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-ium-4-yl]-2-methyl-propyl]-3-[5,7-dimethyl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide Openeye Name: N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-ium-4-yl]-2-methyl-propyl]-3-[5,7-dimethyl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide CAS Name: N-[2-[(2S,6R)-2,6-dimethyl-4-morpholin-4-iumyl]-2-methylpropyl]-3-[5,7-dimethyl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide IUPAC Name: N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-ium-4-yl]-2-methylpropyl]-3-[5,7-dimethyl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide Traditional Name: N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-ium-4-yl]-2-methyl-propyl]-3-[5,7-dimethyl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propionamide Formula: C21H32F3N6O2+ MolecularWeight: 457.51299

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CC(O1)C)C(C)(C)CNC(=O)CCC2=C(N3C(=NC(=N3)C(F)(F)F)N=C2C)C

Isomeric SMILES

C[C@@H]1C[NH+](C[C@@H](O1)C)C(C)(C)CNC(=O)CCC2=C(N3C(=NC(=N3)C(F)(F)F)N=C2C)C

InChI

InChI=1S/C21H31F3N6O2/c1-12-9-29(10-13(2)32-12)20(5,6)11-25-17(31)8-7-16-14(3)26-19-27-18(21(22,23)24)28-30(19)15(16)4/h12-13H,7-11H2,1-6H3,(H,25,31)/p+1/t12-,13+