3-(4-fluorophenyl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(4-fluorophenyl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-1H-pyrazole-5-carboxamide Openeye Name: 3-(4-fluorophenyl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-1H-pyrazole-5-carboxamide CAS Name: 3-(4-fluorophenyl)-N-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]-1H-pyrazole-5-carboxamide IUPAC Name: 3-(4-fluorophenyl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-1H-pyrazole-5-carboxamide Traditional Name: 3-(4-fluorophenyl)-N-[3-[4-(2-pyrimidyl)piperazino]propyl]-1H-pyrazole-5-carboxamide Formula: C21H24FN7O MolecularWeight: 409.459963

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC(=O)C2=CC(=NN2)C3=CC=C(C=C3)F)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCN1CCCNC(=O)C2=CC(=NN2)C3=CC=C(C=C3)F)C4=NC=CC=N4

InChI

InChI=1S/C21H24FN7O/c22-17-5-3-16(4-6-17)18-15-19(27-26-18)20(30)23-9-2-10-28-11-13-29(14-12-28)21-24-7-1-8-25-21/h1,3-8,15H,2,9-14H2,(H,23,30)(H,26,27)