N-(1-tert-butyl-3-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)cyclohexanecarboxamide

Systemtic Name: N-(1-tert-butyl-3-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)cyclohexanecarboxamide Openeye Name: N-(1-tert-butyl-3-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)cyclohexanecarboxamide CAS Name: N-(1-tert-butyl-3-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)cyclohexanecarboxamide IUPAC Name: N-(1-tert-butyl-3-phenylpyrazolo[3,4-d]pyrimidin-4-yl)cyclohexanecarboxamide Traditional Name: N-(1-tert-butyl-3-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)cyclohexanecarboxamide Formula: C22H27N5O MolecularWeight: 377.48268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C2=C(C(=N1)C3=CC=CC=C3)C(=NC=N2)NC(=O)C4CCCCC4

Isomeric SMILES

CC(C)(C)N1C2=C(C(=N1)C3=CC=CC=C3)C(=NC=N2)NC(=O)C4CCCCC4

InChI

InChI=1S/C22H27N5O/c1-22(2,3)27-20-17(18(26-27)15-10-6-4-7-11-15)19(23-14-24-20)25-21(28)16-12-8-5-9-13-16/h4,6-7,10-11,14,16H,5,8-9,12-13H2,1-3H3,(H,23,24,25,28)