4-[1-(4-fluorophenyl)-6-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]-N-propyl-piperazine-1-carboxamide

Systemtic Name: 4-[1-(4-fluorophenyl)-6-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]-N-propyl-piperazine-1-carboxamide Openeye Name: 4-[1-(4-fluorophenyl)-6-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]-N-propyl-piperazine-1-carboxamide CAS Name: 4-[1-(4-fluorophenyl)-6-methyl-4-pyrazolo[3,4-d]pyrimidinyl]-N-propyl-1-piperazinecarboxamide IUPAC Name: 4-[1-(4-fluorophenyl)-6-methylpyrazolo[3,4-d]pyrimidin-4-yl]-N-propylpiperazine-1-carboxamide Traditional Name: 4-[1-(4-fluorophenyl)-6-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]-N-propyl-piperazine-1-carboxamide Formula: C20H24FN7O MolecularWeight: 397.449263

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)N1CCN(CC1)C2=NC(=NC3=C2C=NN3C4=CC=C(C=C4)F)C

Isomeric SMILES

CCCNC(=O)N1CCN(CC1)C2=NC(=NC3=C2C=NN3C4=CC=C(C=C4)F)C

InChI

InChI=1S/C20H24FN7O/c1-3-8-22-20(29)27-11-9-26(10-12-27)18-17-13-23-28(19(17)25-14(2)24-18)16-6-4-15(21)5-7-16/h4-7,13H,3,8-12H2,1-2H3,(H,22,29)