1-phenyl-2-[4-(1H-pyrazolo[3,4-d]pyrimidin-4-ylamino)piperidin-1-yl]ethanone

Systemtic Name: 1-phenyl-2-[4-(1H-pyrazolo[3,4-d]pyrimidin-4-ylamino)piperidin-1-yl]ethanone Openeye Name: 1-phenyl-2-[4-(1H-pyrazolo[3,4-d]pyrimidin-4-ylamino)-1-piperidyl]ethanone CAS Name: 1-phenyl-2-[4-(1H-pyrazolo[3,4-d]pyrimidin-4-ylamino)-1-piperidinyl]ethanone IUPAC Name: 1-phenyl-2-[4-(1H-pyrazolo[3,4-d]pyrimidin-4-ylamino)piperidin-1-yl]ethanone Traditional Name: 1-phenyl-2-[4-(1H-pyrazolo[3,4-d]pyrimidin-4-ylamino)piperidino]ethanone Formula: C18H20N6O MolecularWeight: 336.391

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC2=NC=NC3=C2C=NN3)CC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1NC2=NC=NC3=C2C=NN3)CC(=O)C4=CC=CC=C4

InChI

InChI=1S/C18H20N6O/c25-16(13-4-2-1-3-5-13)11-24-8-6-14(7-9-24)22-17-15-10-21-23-18(15)20-12-19-17/h1-5,10,12,14H,6-9,11H2,(H2,19,20,21,22,23)