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

Systemtic Name: 4-[1-(2-chlorophenyl)-6-ethyl-pyrazolo[3,4-d]pyrimidin-4-yl]-N-propyl-piperazine-1-carboxamide Openeye Name: 4-[1-(2-chlorophenyl)-6-ethyl-pyrazolo[3,4-d]pyrimidin-4-yl]-N-propyl-piperazine-1-carboxamide CAS Name: 4-[1-(2-chlorophenyl)-6-ethyl-4-pyrazolo[3,4-d]pyrimidinyl]-N-propyl-1-piperazinecarboxamide IUPAC Name: 4-[1-(2-chlorophenyl)-6-ethylpyrazolo[3,4-d]pyrimidin-4-yl]-N-propylpiperazine-1-carboxamide Traditional Name: 4-[1-(2-chlorophenyl)-6-ethyl-pyrazolo[3,4-d]pyrimidin-4-yl]-N-propyl-piperazine-1-carboxamide Formula: C21H26ClN7O MolecularWeight: 427.93044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)N1CCN(CC1)C2=NC(=NC3=C2C=NN3C4=CC=CC=C4Cl)CC

Isomeric SMILES

CCCNC(=O)N1CCN(CC1)C2=NC(=NC3=C2C=NN3C4=CC=CC=C4Cl)CC

InChI

InChI=1S/C21H26ClN7O/c1-3-9-23-21(30)28-12-10-27(11-13-28)19-15-14-24-29(17-8-6-5-7-16(17)22)20(15)26-18(4-2)25-19/h5-8,14H,3-4,9-13H2,1-2H3,(H,23,30)