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

Systemtic Name: N-[4-(4-azanyl-1-tert-butyl-pyrazolo[3,4-d]pyrimidin-3-yl)phenyl]cyclopentanecarboxamide Openeye Name: N-[4-(4-amino-1-tert-butyl-pyrazolo[3,4-d]pyrimidin-3-yl)phenyl]cyclopentanecarboxamide CAS Name: N-[4-(4-amino-1-tert-butyl-3-pyrazolo[3,4-d]pyrimidinyl)phenyl]cyclopentanecarboxamide IUPAC Name: N-[4-(4-amino-1-tert-butylpyrazolo[3,4-d]pyrimidin-3-yl)phenyl]cyclopentanecarboxamide Traditional Name: N-[4-(4-amino-1-tert-butyl-pyrazolo[3,4-d]pyrimidin-3-yl)phenyl]cyclopentanecarboxamide Formula: C21H26N6O MolecularWeight: 378.47074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C2=C(C(=N1)C3=CC=C(C=C3)NC(=O)C4CCCC4)C(=NC=N2)N

Isomeric SMILES

CC(C)(C)N1C2=C(C(=N1)C3=CC=C(C=C3)NC(=O)C4CCCC4)C(=NC=N2)N

InChI

InChI=1S/C21H26N6O/c1-21(2,3)27-19-16(18(22)23-12-24-19)17(26-27)13-8-10-15(11-9-13)25-20(28)14-6-4-5-7-14/h8-12,14H,4-7H2,1-3H3,(H,25,28)(H2,22,23,24)