4-[1-(2-chlorophenyl)-6-ethyl-pyrazolo[3,4-d]pyrimidin-4-yl]-N-ethyl-piperazine-1-carboxamide

Systemtic Name: 4-[1-(2-chlorophenyl)-6-ethyl-pyrazolo[3,4-d]pyrimidin-4-yl]-N-ethyl-piperazine-1-carboxamide Openeye Name: 4-[1-(2-chlorophenyl)-6-ethyl-pyrazolo[3,4-d]pyrimidin-4-yl]-N-ethyl-piperazine-1-carboxamide CAS Name: 4-[1-(2-chlorophenyl)-6-ethyl-4-pyrazolo[3,4-d]pyrimidinyl]-N-ethyl-1-piperazinecarboxamide IUPAC Name: 4-[1-(2-chlorophenyl)-6-ethylpyrazolo[3,4-d]pyrimidin-4-yl]-N-ethylpiperazine-1-carboxamide Traditional Name: 4-[1-(2-chlorophenyl)-6-ethyl-pyrazolo[3,4-d]pyrimidin-4-yl]-N-ethyl-piperazine-1-carboxamide Formula: C20H24ClN7O MolecularWeight: 413.90386

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=NN2C3=CC=CC=C3Cl)C(=N1)N4CCN(CC4)C(=O)NCC

Isomeric SMILES

CCC1=NC2=C(C=NN2C3=CC=CC=C3Cl)C(=N1)N4CCN(CC4)C(=O)NCC

InChI

InChI=1S/C20H24ClN7O/c1-3-17-24-18(26-9-11-27(12-10-26)20(29)22-4-2)14-13-23-28(19(14)25-17)16-8-6-5-7-15(16)21/h5-8,13H,3-4,9-12H2,1-2H3,(H,22,29)