N-(3-methylphenyl)-6-morpholin-4-yl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-(3-methylphenyl)-6-morpholin-4-yl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 6-morpholino-N-(m-tolyl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-(3-methylphenyl)-6-(4-morpholinyl)-1-phenyl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-(3-methylphenyl)-6-morpholin-4-yl-1-phenylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (6-morpholino-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)-(m-tolyl)amine Formula: C22H22N6O MolecularWeight: 386.44968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC(=NC3=C2C=NN3C4=CC=CC=C4)N5CCOCC5

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC(=NC3=C2C=NN3C4=CC=CC=C4)N5CCOCC5

InChI

InChI=1S/C22H22N6O/c1-16-6-5-7-17(14-16)24-20-19-15-23-28(18-8-3-2-4-9-18)21(19)26-22(25-20)27-10-12-29-13-11-27/h2-9,14-15H,10-13H2,1H3,(H,24,25,26)