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

Systemtic Name: 4-[1-(2-chlorophenyl)-6-cyclopropyl-pyrazolo[3,4-d]pyrimidin-4-yl]-N-propan-2-yl-piperazine-1-carboxamide Openeye Name: 4-[1-(2-chlorophenyl)-6-cyclopropyl-pyrazolo[3,4-d]pyrimidin-4-yl]-N-isopropyl-piperazine-1-carboxamide CAS Name: 4-[1-(2-chlorophenyl)-6-cyclopropyl-4-pyrazolo[3,4-d]pyrimidinyl]-N-propan-2-yl-1-piperazinecarboxamide IUPAC Name: 4-[1-(2-chlorophenyl)-6-cyclopropylpyrazolo[3,4-d]pyrimidin-4-yl]-N-propan-2-ylpiperazine-1-carboxamide Traditional Name: 4-[1-(2-chlorophenyl)-6-cyclopropyl-pyrazolo[3,4-d]pyrimidin-4-yl]-N-isopropyl-piperazine-1-carboxamide Formula: C22H26ClN7O MolecularWeight: 439.94114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)N1CCN(CC1)C2=NC(=NC3=C2C=NN3C4=CC=CC=C4Cl)C5CC5

Isomeric SMILES

CC(C)NC(=O)N1CCN(CC1)C2=NC(=NC3=C2C=NN3C4=CC=CC=C4Cl)C5CC5

InChI

InChI=1S/C22H26ClN7O/c1-14(2)25-22(31)29-11-9-28(10-12-29)20-16-13-24-30(18-6-4-3-5-17(18)23)21(16)27-19(26-20)15-7-8-15/h3-6,13-15H,7-12H2,1-2H3,(H,25,31)