5-methyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carboxamide

Systemtic Name: 5-methyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carboxamide Openeye Name: 5-methyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carboxamide CAS Name: 5-methyl-N-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]-1-[3-(trifluoromethyl)phenyl]-4-pyrazolecarboxamide IUPAC Name: 5-methyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carboxamide Traditional Name: 5-methyl-N-[3-[4-(2-pyrimidyl)piperazino]propyl]-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carboxamide Formula: C23H26F3N7O MolecularWeight: 473.49405

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)NCCCN3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)NCCCN3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C23H26F3N7O/c1-17-20(16-30-33(17)19-6-2-5-18(15-19)23(24,25)26)21(34)27-9-4-10-31-11-13-32(14-12-31)22-28-7-3-8-29-22/h2-3,5-8,15-16H,4,9-14H2,1H3,(H,27,34)