N-[4-(4-azanyl-1-piperidin-4-yl-pyrazolo[3,4-d]pyrimidin-3-yl)phenyl]-3-phenyl-1,2-oxazol-5-amine

Systemtic Name: N-[4-(4-azanyl-1-piperidin-4-yl-pyrazolo[3,4-d]pyrimidin-3-yl)phenyl]-3-phenyl-1,2-oxazol-5-amine Openeye Name: N-[4-[4-amino-1-(4-piperidyl)pyrazolo[3,4-d]pyrimidin-3-yl]phenyl]-3-phenyl-isoxazol-5-amine CAS Name: N-[4-[4-amino-1-(4-piperidinyl)-3-pyrazolo[3,4-d]pyrimidinyl]phenyl]-3-phenyl-5-isoxazolamine IUPAC Name: N-[4-(4-amino-1-piperidin-4-ylpyrazolo[3,4-d]pyrimidin-3-yl)phenyl]-3-phenyl-1,2-oxazol-5-amine Traditional Name: [4-[4-amino-1-(4-piperidyl)pyrazolo[3,4-d]pyrimidin-3-yl]phenyl]-(3-phenylisoxazol-5-yl)amine Formula: C25H24N8O MolecularWeight: 452.51106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1N2C3=C(C(=N2)C4=CC=C(C=C4)NC5=CC(=NO5)C6=CC=CC=C6)C(=NC=N3)N

Isomeric SMILES

C1CNCCC1N2C3=C(C(=N2)C4=CC=C(C=C4)NC5=CC(=NO5)C6=CC=CC=C6)C(=NC=N3)N

InChI

InChI=1S/C25H24N8O/c26-24-22-23(31-33(25(22)29-15-28-24)19-10-12-27-13-11-19)17-6-8-18(9-7-17)30-21-14-20(32-34-21)16-4-2-1-3-5-16/h1-9,14-15,19,27,30H,10-13H2,(H2,26,28,29)