1-methyl-3-[4-(4-morpholin-4-yl-1-piperidin-4-yl-pyrazolo[3,4-d]pyrimidin-6-yl)phenyl]urea

Systemtic Name: 1-methyl-3-[4-(4-morpholin-4-yl-1-piperidin-4-yl-pyrazolo[3,4-d]pyrimidin-6-yl)phenyl]urea Openeye Name: 1-methyl-3-[4-[4-morpholino-1-(4-piperidyl)pyrazolo[3,4-d]pyrimidin-6-yl]phenyl]urea CAS Name: 1-methyl-3-[4-[4-(4-morpholinyl)-1-(4-piperidinyl)-6-pyrazolo[3,4-d]pyrimidinyl]phenyl]urea IUPAC Name: 1-methyl-3-[4-(4-morpholin-4-yl-1-piperidin-4-ylpyrazolo[3,4-d]pyrimidin-6-yl)phenyl]urea Traditional Name: 1-methyl-3-[4-[4-morpholino-1-(4-piperidyl)pyrazolo[3,4-d]pyrimidin-6-yl]phenyl]urea Formula: C22H28N8O2 MolecularWeight: 436.51012

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC1=CC=C(C=C1)C2=NC3=C(C=NN3C4CCNCC4)C(=N2)N5CCOCC5

Isomeric SMILES

CNC(=O)NC1=CC=C(C=C1)C2=NC3=C(C=NN3C4CCNCC4)C(=N2)N5CCOCC5

InChI

InChI=1S/C22H28N8O2/c1-23-22(31)26-16-4-2-15(3-5-16)19-27-20(29-10-12-32-13-11-29)18-14-25-30(21(18)28-19)17-6-8-24-9-7-17/h2-5,14,17,24H,6-13H2,1H3,(H2,23,26,31)