N-[(1R,3S)-3-phenethyloxycyclopentyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-[(1R,3S)-3-phenethyloxycyclopentyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-[(1R,3S)-3-phenethyloxycyclopentyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-[(1R,3S)-3-phenethyloxycyclopentyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine IUPAC Name: N-[(1R,3S)-3-phenethyloxycyclopentyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [(1R,3S)-3-phenethyloxycyclopentyl]-(1H-pyrazolo[3,4-d]pyrimidin-4-yl)amine Formula: C18H21N5O MolecularWeight: 323.39224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC1NC2=NC=NC3=C2C=NN3)OCCC4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](C[C@@H]1NC2=NC=NC3=C2C=NN3)OCCC4=CC=CC=C4

InChI

InChI=1S/C18H21N5O/c1-2-4-13(5-3-1)8-9-24-15-7-6-14(10-15)22-17-16-11-21-23-18(16)20-12-19-17/h1-5,11-12,14-15H,6-10H2,(H2,19,20,21,22,23)/t14-,15+/m1/s1