2-(4-pyrimidin-2-ylpiperazin-1-yl)-N-[2,2,2-tris(fluoranyl)ethylcarbamoyl]propanamide

Systemtic Name: 2-(4-pyrimidin-2-ylpiperazin-1-yl)-N-[2,2,2-tris(fluoranyl)ethylcarbamoyl]propanamide Openeye Name: 2-(4-pyrimidin-2-ylpiperazin-1-yl)-N-(2,2,2-trifluoroethylcarbamoyl)propanamide CAS Name: N-[oxo-(2,2,2-trifluoroethylamino)methyl]-2-[4-(2-pyrimidinyl)-1-piperazinyl]propanamide IUPAC Name: 2-(4-pyrimidin-2-ylpiperazin-1-yl)-N-(2,2,2-trifluoroethylcarbamoyl)propanamide Traditional Name: 2-[4-(2-pyrimidyl)piperazino]-N-(2,2,2-trifluoroethylcarbamoyl)propionamide Formula: C14H19F3N6O2 MolecularWeight: 360.33487

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NCC(F)(F)F)N1CCN(CC1)C2=NC=CC=N2

Isomeric SMILES

CC(C(=O)NC(=O)NCC(F)(F)F)N1CCN(CC1)C2=NC=CC=N2

InChI

InChI=1S/C14H19F3N6O2/c1-10(11(24)21-13(25)20-9-14(15,16)17)22-5-7-23(8-6-22)12-18-3-2-4-19-12/h2-4,10H,5-9H2,1H3,(H2,20,21,24,25)