1-[1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-N,N-diethyl-piperidine-4-carboxamide

Systemtic Name: 1-[1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-N,N-diethyl-piperidine-4-carboxamide Openeye Name: 1-[1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-N,N-diethyl-piperidine-4-carboxamide CAS Name: 1-[1-(4-chlorophenyl)-4-pyrazolo[3,4-d]pyrimidinyl]-N,N-diethyl-4-piperidinecarboxamide IUPAC Name: 1-[1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-N,N-diethylpiperidine-4-carboxamide Traditional Name: 1-[1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-N,N-diethyl-isonipecotamide Formula: C21H25ClN6O MolecularWeight: 412.9158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1CCN(CC1)C2=NC=NC3=C2C=NN3C4=CC=C(C=C4)Cl

Isomeric SMILES

CCN(CC)C(=O)C1CCN(CC1)C2=NC=NC3=C2C=NN3C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H25ClN6O/c1-3-26(4-2)21(29)15-9-11-27(12-10-15)19-18-13-25-28(20(18)24-14-23-19)17-7-5-16(22)6-8-17/h5-8,13-15H,3-4,9-12H2,1-2H3