tert-butyl 5-(4-azanyl-1-cyclopentyl-pyrazolo[3,4-d]pyrimidin-3-yl)indole-1-carboxylate

Systemtic Name: tert-butyl 5-(4-azanyl-1-cyclopentyl-pyrazolo[3,4-d]pyrimidin-3-yl)indole-1-carboxylate Openeye Name: tert-butyl 5-(4-amino-1-cyclopentyl-pyrazolo[3,4-d]pyrimidin-3-yl)indole-1-carboxylate CAS Name: 5-(4-amino-1-cyclopentyl-3-pyrazolo[3,4-d]pyrimidinyl)-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-(4-amino-1-cyclopentylpyrazolo[3,4-d]pyrimidin-3-yl)indole-1-carboxylate Traditional Name: 5-(4-amino-1-cyclopentyl-pyrazolo[3,4-d]pyrimidin-3-yl)indole-1-carboxylic acid tert-butyl ester Formula: C23H26N6O2 MolecularWeight: 418.49154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=CC2=C1C=CC(=C2)C3=NN(C4=C3C(=NC=N4)N)C5CCCC5

Isomeric SMILES

CC(C)(C)OC(=O)N1C=CC2=C1C=CC(=C2)C3=NN(C4=C3C(=NC=N4)N)C5CCCC5

InChI

InChI=1S/C23H26N6O2/c1-23(2,3)31-22(30)28-11-10-14-12-15(8-9-17(14)28)19-18-20(24)25-13-26-21(18)29(27-19)16-6-4-5-7-16/h8-13,16H,4-7H2,1-3H3,(H2,24,25,26)