N-cyclohexyl-4-[6-(2-methylpropyl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl]piperazine-1-carboxamide

Systemtic Name: N-cyclohexyl-4-[6-(2-methylpropyl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl]piperazine-1-carboxamide Openeye Name: N-cyclohexyl-4-(6-isobutyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazine-1-carboxamide CAS Name: N-cyclohexyl-4-[6-(2-methylpropyl)-1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: N-cyclohexyl-4-[6-(2-methylpropyl)-1-phenylpyrazolo[3,4-d]pyrimidin-4-yl]piperazine-1-carboxamide Traditional Name: N-cyclohexyl-4-(6-isobutyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazine-1-carboxamide Formula: C26H35N7O MolecularWeight: 461.6024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)N4CCN(CC4)C(=O)NC5CCCCC5

Isomeric SMILES

CC(C)CC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)N4CCN(CC4)C(=O)NC5CCCCC5

InChI

InChI=1S/C26H35N7O/c1-19(2)17-23-29-24(22-18-27-33(25(22)30-23)21-11-7-4-8-12-21)31-13-15-32(16-14-31)26(34)28-20-9-5-3-6-10-20/h4,7-8,11-12,18-20H,3,5-6,9-10,13-17H2,1-2H3,(H,28,34)