3-cyclohexyl-N-[2-[4-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]propanamide

Systemtic Name: 3-cyclohexyl-N-[2-[4-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]propanamide Openeye Name: 3-cyclohexyl-N-[2-[4-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]propanamide CAS Name: 3-cyclohexyl-N-[2-[4-(4-phenyl-1-piperazinyl)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]propanamide IUPAC Name: 3-cyclohexyl-N-[2-[4-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]propanamide Traditional Name: 3-cyclohexyl-N-[2-[4-(4-phenylpiperazino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]propionamide Formula: C26H35N7O MolecularWeight: 461.6024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC(=O)NCCN2C3=C(C=N2)C(=NC=N3)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)CCC(=O)NCCN2C3=C(C=N2)C(=NC=N3)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C26H35N7O/c34-24(12-11-21-7-3-1-4-8-21)27-13-14-33-26-23(19-30-33)25(28-20-29-26)32-17-15-31(16-18-32)22-9-5-2-6-10-22/h2,5-6,9-10,19-21H,1,3-4,7-8,11-18H2,(H,27,34)